SCHEMBL29358385

SCHEMBL29358385

CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)NCCSS(C)(=O)=O)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.74
▸ USP2 O75604 1/20 0.74
▸ POLB P06746 1/20 0.74
▸ PPARG P37231 1/20 0.74
▸ BLM P54132 1/20 0.74
▸ KMT2A Q03164 1/20 0.74
▸ RXFP1 Q9HBX9 1/20 0.74
▸ NCOR2 Q9Y618 1/20 0.74
▸ CHRM1 P11229 2/20 0.56
▸ SLC6A4 P31645 9/20 0.53
▸ SLC6A2 P23975 5/20 0.53
▸ SLC6A3 Q01959 5/20 0.53
▸ APLNR P35414 2/20 0.50
▸ AVPR2 P30518 3/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16593559 1.00 MEN1 (0.74) MEN1USP2POLBPPARGBLM
SCHEMBL29674723 0.89 MEN1 (0.79) MEN1USP2POLBPPARGBLM
SCHEMBL30063035 0.89 MEN1 (0.79) MEN1USP2POLBPPARGBLM
Hydrochloric Acid SCHEMBL19125055 0.89 MEN1 (0.78) MEN1USP2POLBPPARGBLM
SCHEMBL15377173 0.87 MEN1 (0.75) MEN1USP2POLBPPARGBLM
SCHEMBL15941218 0.86 MEN1 (0.79) MEN1USP2POLBPPARGBLM
SCHEMBL20223287 0.86 MEN1 (0.67) MEN1USP2POLBPPARGBLM
SCHEMBL29355331 0.86 MEN1 (1.00) MEN1USP2POLBPPARGBLM
SCHEMBL16593265 0.86 MEN1 (1.00) MEN1USP2POLBPPARGBLM
SCHEMBL29367408 0.85 MEN1 (0.72) MEN1USP2POLBPPARGBLM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 93 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3776183-B1 METHOD AND PLATFORM FOR DEPLOYMENT OF AN INDUSTRIAL APPLICATION ON AN EDGE COMPUTING DEVICE OF A MACHINE TOOL SIEMENS AG (DE) 2024-12-04 — — EP claimed
CN-118731103-A Method for measuring MTSR in semi-batch chemical reaction with heat of solution 山东润博安全科技有限公司 2024-10-01 — — CN claimed
CN-118675635-A Reaction risk assessment method for endothermic reaction 浙江化安安全技术研究院有限公司 2024-09-20 — — CN claimed
CN-118116485-A Reaction risk assessment method of continuous fluidized bed 浙江化安安全技术研究院有限公司 2024-05-31 — — CN claimed
CN-118116486-A Reaction risk assessment method for continuous fixed bed 浙江化安安全技术研究院有限公司 2024-05-31 — — CN claimed
CN-117912580-A Reaction risk assessment method for continuous tube reactor 浙江化安安全技术研究院有限公司 2024-04-19 — — CN claimed
CN-114780476-B SPI time-sharing multiplexing circuit supporting multiple masters and multiple slaves 北京经纬恒润科技股份有限公司 2024-03-22 — — CN claimed
US-11880190-B2 Method and platform for deployment of an industrial application on an edge computing device of a machine tool SIEMENS AKTIENGESELLSCHAFT 2024-01-23 — — US claimed
CN-117347433-A Method for rapidly judging most dangerous phase of thermal runaway of energetic material synthesis reaction 西安近代化学研究所 2024-01-05 — — CN claimed
CN-113722251-B Two-wire SPI communication system and method for functional safety monitoring 上海汽车变速器有限公司 2023-12-26 — — CN claimed
CN-108535315-B Method and device for measuring calorimetric heat in non-isothermal reaction process 沈阳化工研究院有限公司 2023-12-15 — — CN claimed
CN-116631523-A Identification method of semi-intermittent reaction thermal behavior based on neural network 河北工业大学 2023-08-22 — — CN claimed
CN-116153427-A Method for reducing thermal runaway risk by adopting high-boiling point solvent in fine chemical production process 国科广化精细化工孵化器(南雄)有限公司 2023-05-23 — — CN claimed
CN-112067657-B Method for determining temperature correction coefficient of energetic material chemical combination process 西安近代化学研究所 2023-04-18 — — CN claimed
EP-4153210-A2 MULTI-EPITOPE VACCINE FOR THE TREATMENT OF ALZHEIMER'S DISEASE OTHAIR PROTHENA LIMITED (IE) 2023-03-29 — — EP claimed
CN-115791682-A Method and system for measuring and calculating MTSR (maximum Transmission Shift keying) evaluation parameter of reaction hot air risk based on in-situ infrared 浙江工业大学 2023-03-14 — — CN claimed
CN-110414868-B Method for evaluating thermal runaway risk degree in chemical process 南京工业大学 2022-12-13 — — CN claimed
CN-115204582-A Risk grading assessment method, system and device for chemical dangerous process 南京南工应急科技有限公司 2022-10-18 — — CN claimed
CN-114780476-A SPI time-sharing multiplexing circuit supporting multiple masters and multiple slaves 北京经纬恒润科技股份有限公司 2022-07-22 — — CN claimed
CN-122109200-A Thermal safety risk assessment method for benzoic acid reduction reaction — 2026-05-29 — — CN disclosed
US-20260002205-A1 METHOD OF IDENTIFYING ALLOSTERIC BIOSENSOR PROTEINS WITH NEW SPECIFICITIES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2026-01-01 — — US disclosed
CN-112106024-B Method and platform for deploying industrial applications on edge computing devices of machine tools 西门子股份公司 2025-06-27 — — CN disclosed
CN-119977846-A Aniline oxidation reaction process and thermal safety risk assessment method 上海泓博尚奕药物技术有限公司 2025-05-13 — — CN disclosed
CN-112162505-B Analog throttle signal generation and switching circuit 北京智行者科技股份有限公司 2025-05-06 — — CN disclosed
CN-119936113-A Thermal safety risk assessment method for benzyl alcohol oxidation reaction 上海泓博尚奕药物技术有限公司 2025-05-06 — — CN disclosed
CN-119870577-A Strip steel slitting machine with adjustable shearing column number and column number adjusting method 唐山市丰丰冷轧带钢有限公司 2025-04-25 — — CN disclosed
CN-119851782-A Method, system and storage medium for rapidly acquiring risk control important parameter TMR 沈阳化工研究院有限公司 2025-04-18 — — CN disclosed
CN-119761819-A Fine chemical engineering multi-factor coupling reaction security risk assessment method and system 沈阳化工研究院有限公司 2025-04-04 — — CN disclosed
US-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES UNIVERSITY OF WASHINGTON 2025-04-03 — — US disclosed
CN-119733511-A Methanol reforming hydrogen production CuO/ZrO2Catalyst, preparation method and application thereof 南昌大学 2025-04-01 — — CN disclosed
EP-3776183-B1 METHOD AND PLATFORM FOR DEPLOYMENT OF AN INDUSTRIAL APPLICATION ON AN EDGE COMPUTING DEVICE OF A MACHINE TOOL SIEMENS AG (DE) 2024-12-04 — — EP disclosed
CN-118920713-A Multi-emission high-order Anti-PT symmetrical wireless power transmission system and method 同济大学 2024-11-08 — — CN disclosed
CN-113724794-B Method and system for monitoring and early warning of chemical reaction runaway 中国石油化工股份有限公司 2024-10-29 — — CN disclosed
CN-118731103-A Method for measuring MTSR in semi-batch chemical reaction with heat of solution 山东润博安全科技有限公司 2024-10-01 — — CN disclosed
CN-118731103-A Method for measuring MTSR in semi-batch chemical reaction with heat of solution 山东润博安全科技有限公司 2024-10-01 — — CN disclosed
CN-118731103-A Method for measuring MTSR in semi-batch chemical reaction with heat of solution 山东润博安全科技有限公司 2024-10-01 — — CN disclosed
CN-118675635-A Reaction risk assessment method for endothermic reaction 浙江化安安全技术研究院有限公司 2024-09-20 — — CN disclosed
CN-118286964-A Double-reaction type alkoxylation reactor 山东博克工业装备有限公司 2024-07-05 — — CN disclosed
US-20240215826-A1 DEVICES AND METHODS FOR IN VIVO TISSUE EVALUATION UNIV TEXAS (US) 2024-07-04 — — US disclosed
CN-117314167-B Continuous flow gas phase reaction safety risk assessment method in tubular reactor 山东润博安全科技有限公司 2024-06-18 — — CN disclosed
CN-118116485-A Reaction risk assessment method of continuous fluidized bed 浙江化安安全技术研究院有限公司 2024-05-31 — — CN disclosed
CN-118116486-A Reaction risk assessment method for continuous fixed bed 浙江化安安全技术研究院有限公司 2024-05-31 — — CN disclosed
CN-114326687-B Power domain controller of new energy vehicle and vehicle 摩登汽车有限公司 2024-05-24 — — CN disclosed
CN-117953983-A Method for carrying out reaction security risk assessment by combining actual heat dissipation rate of device 浙江化安安全技术研究院有限公司 2024-04-30 — — CN disclosed
CN-220842468-U Emergency unlocking circuit for back tail gate and domain controller 联合汽车电子有限公司 2024-04-26 — — CN disclosed
CN-117912580-A Reaction risk assessment method for continuous tube reactor 浙江化安安全技术研究院有限公司 2024-04-19 — — CN disclosed
CN-117823815-A Safer supercharging device for high-pressure hydrogenation experiment 浙江化安安全技术研究院有限公司 2024-04-05 — — CN disclosed
CN-114780476-B SPI time-sharing multiplexing circuit supporting multiple masters and multiple slaves 北京经纬恒润科技股份有限公司 2024-03-22 — — CN disclosed
CN-117603114-A Safe preparation method of tert-butyl hydroperoxide 沈阳化工研究院有限公司 2024-02-27 — — CN disclosed
US-11880190-B2 Method and platform for deployment of an industrial application on an edge computing device of a machine tool SIEMENS AKTIENGESELLSCHAFT 2024-01-23 — — US disclosed
US-11880190-B2 Method and platform for deployment of an industrial application on an edge computing device of a machine tool SIEMENS AKTIENGESELLSCHAFT 2024-01-23 — — US disclosed
US-11872206-B2 Purified forms of rofecoxib, methods of manufacture and use Tremeau Pharmaceuticals, Inc. (US) 2024-01-16 — — US disclosed
CN-117347433-A Method for rapidly judging most dangerous phase of thermal runaway of energetic material synthesis reaction 西安近代化学研究所 2024-01-05 — — CN disclosed
CN-117314167-A Continuous flow gas phase reaction safety risk assessment method in tubular reactor 山东润博安全科技有限公司 2023-12-29 — — CN disclosed
CN-113722251-B Two-wire SPI communication system and method for functional safety monitoring 上海汽车变速器有限公司 2023-12-26 — — CN disclosed
CN-113722251-B Two-wire SPI communication system and method for functional safety monitoring 上海汽车变速器有限公司 2023-12-26 — — CN disclosed
CN-117136181-A Preparation method of intermediate for synthesizing sphingosine-1-phosphate receptor agonist 株式会社LG化学 2023-11-28 — — CN disclosed
CN-117096842-A Electronic fuse circuit and vehicle 联合汽车电子有限公司 2023-11-21 — — CN disclosed
CN-219715292-U Transmission structure of full-automatic reaction calorimeter 宜昌东阳光制药有限公司 2023-09-19 — — CN disclosed
CN-116643863-A Multi-objective multi-task evolutionary optimization method based on similarity multi-source selection strategy 燕山大学 2023-08-25 — — CN disclosed
CN-116631523-A Identification method of semi-intermittent reaction thermal behavior based on neural network 河北工业大学 2023-08-22 — — CN disclosed
CN-115273998-B Chemical reaction risk analysis method 沈阳化工研究院有限公司 2023-07-28 — — CN disclosed
CN-115858446-B Method, device and system for serial peripheral interface bus data transmission 北京紫光芯能科技有限公司 2023-07-04 — — CN disclosed
CN-106251897-B Ferroelectric memory circuit of battery management system of electric automobile 合肥国轩高科动力能源有限公司 2023-06-09 — — CN disclosed
CN-116153427-A Method for reducing thermal runaway risk by adopting high-boiling point solvent in fine chemical production process 国科广化精细化工孵化器(南雄)有限公司 2023-05-23 — — CN disclosed
CN-116153427-A Method for reducing thermal runaway risk by adopting high-boiling point solvent in fine chemical production process 国科广化精细化工孵化器(南雄)有限公司 2023-05-23 — — CN disclosed
CN-112067657-B Method for determining temperature correction coefficient of energetic material chemical combination process 西安近代化学研究所 2023-04-18 — — CN disclosed
US-11617735-B2 Purified forms of rofecoxib, methods of manufacture and use Tremeau Pharmaceuticals, Inc. (US) 2023-04-04 — — US disclosed
CN-115877250-A Voltage inspection control system 上海捷氢科技股份有限公司 2023-03-31 — — CN disclosed
CN-115858446-A Method, device and system for serial peripheral interface bus data transmission 北京紫光芯能科技有限公司 2023-03-28 — — CN disclosed
CN-115837261-A Device and method for continuous flow synthesis of aryl azide compound 爱斯特(成都)生物制药股份有限公司 2023-03-24 — — CN disclosed
CN-115791682-A Method and system for measuring and calculating MTSR (maximum Transmission Shift keying) evaluation parameter of reaction hot air risk based on in-situ infrared 浙江工业大学 2023-03-14 — — CN disclosed
CN-115791682-A Method and system for measuring and calculating MTSR (maximum Transmission Shift keying) evaluation parameter of reaction hot air risk based on in-situ infrared 浙江工业大学 2023-03-14 — — CN disclosed
CN-115791682-A Method and system for measuring and calculating MTSR (maximum Transmission Shift keying) evaluation parameter of reaction hot air risk based on in-situ infrared 浙江工业大学 2023-03-14 — — CN disclosed
US-11576890-B2 Purified forms of rofecoxib, methods of manufacture and use Tremeau Pharmaceuticals, Inc. (US) 2023-02-14 — — US disclosed
CN-115651036-A Method for preparing azithromycin by using microchannel reactor 山东安信制药有限公司 2023-01-31 — — CN disclosed
US-11559509-B2 Purified forms of rofecoxib, methods of manufacture and use Tremeau Pharmaceuticals, Inc. (US) 2023-01-24 — — US disclosed
CN-113470757-B Thermal risk analysis method for diazotization process 甘肃省化工研究院有限责任公司 2023-01-03 — — CN disclosed
US-20220409568-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE Tremeau Pharmaceuticals, Inc. (US) 2022-12-29 — — US disclosed
CN-110874630-B Deep learning-based numerical model product downscaling refinement method 中国人民解放军空军研究院战场环境研究所 2022-12-13 — — CN disclosed
US-20220378736-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE Tremeau Pharmaceuticals, Inc. (US) 2022-12-01 — — US disclosed
US-20220362206-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE Tremeau Pharmaceuticals, Inc. (US) 2022-11-17 — — US disclosed
WO-2022238963-A2 GENETICALLY ENGINEERED IMMUNE CELLS TARGETING CD70 FOR USE IN TREATING SOLID TUMORS CRISPR THERAPEUTICS AG (CH) 2022-11-17 — — WO disclosed
CN-115273998-A Chemical reaction risk analysis method 沈阳化工研究院有限公司 2022-11-01 — — CN disclosed
WO-2022220612-A1 METHOD FOR PREPARING INTERMEDIATE FOR SYNTHESIS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST 주식회사 엘지화학 2022-10-20 — — WO disclosed
CN-115204582-A Risk grading assessment method, system and device for chemical dangerous process 南京南工应急科技有限公司 2022-10-18 — — CN disclosed
CN-115004154-A Instruction level context switching in SIMD processors 苹果公司 2022-09-02 — — CN disclosed
CN-114780476-A SPI time-sharing multiplexing circuit supporting multiple masters and multiple slaves 北京经纬恒润科技股份有限公司 2022-07-22 — — CN disclosed
US-11360780-B2 Instruction-level context switch in SIMD processor APPLE INC. (US) 2022-06-14 — — US disclosed
CN-113121356-B Automatic power continuous nitration method and device 中化安全科学研究(沈阳)有限公司 2022-06-14 — — CN disclosed
CN-114326687-A Power domain controller of new energy vehicle and vehicle 摩登汽车有限公司 2022-04-12 — — CN disclosed
US-11243509-B2 Method for assessing safety integrity level of offshore oil well control equipment CHINA UNIVERSITY OF PETROLEUM (EAST CHINA) (CN) 2022-02-08 — — US disclosed
EP-3621726-B1 METHOD AND SYSTEM FOR MONITORING THE OPERATING CONDITIONS OF A SEMIBATCH REACTOR MITEC S R L SOC DI INGEGNERIA (IT) 2022-01-26 — — EP disclosed
EP-3621726-B1 METHOD AND SYSTEM FOR MONITORING THE OPERATING CONDITIONS OF A SEMIBATCH REACTOR MITEC S R L SOC DI INGEGNERIA (IT) 2022-01-26 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220378736-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-20260002205-A1 METHOD OF IDENTIFYING ALLOSTERIC BIOSENSOR PROTEINS WITH NEW SPECIFICITIES RNGTT, PHAX, PURB MEN1 3552/4885USP2 3873/4885POLB 334/4885
US-11872206-B2 Purified forms of rofecoxib, methods of manufacture and use ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-11617735-B2 Purified forms of rofecoxib, methods of manufacture and use ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-20220362206-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-11559509-B2 Purified forms of rofecoxib, methods of manufacture and use ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-11576890-B2 Purified forms of rofecoxib, methods of manufacture and use ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885
US-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES DHFR, CCNH, ODC1 MEN1 2382/4885USP2 1739/4885POLB 257/4885
US-20220409568-A1 PURIFIED FORMS OF ROFECOXIB, METHODS OF MANUFACTURE AND USE ITGA2B, F13B, F11 MEN1 3551/4885USP2 3981/4885POLB 1544/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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