SCHEMBL2760739

SCHEMBL2760739

CCCCN1C=CN(C)C1.Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.41
PKM P14618 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALB P02768 1/20 0.37
CYP2C9 P11712 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MBTD1 Q05BQ5 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP1A2 P05177 1/20 0.36
ADORA2B P29275 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL28840031 0.95 ALDH1A1 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL28433562 0.95 ALDH1A1 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL28226770 0.95 ALDH1A1 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL28365499 0.95 ALDH1A1 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL28493505 0.89 CYP2D6 (0.41) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL28366311 0.88 CYP2D6 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL27654379 0.88 TSHR (0.44) PKMALDH1A1TSHRLMNATDP1
SCHEMBL2761059 0.87 CYP2D6 (0.44) CYP2D6PKMKMT2AALDH1A1TSHR
SCHEMBL29043454 0.87 CYP2D6 (0.40) CYP2D6PKMKMT2AMEN1ALDH1A1
SCHEMBL29110895 0.83 CYP2D6 (0.39) CYP2D6PKMKMT2AALDH1A1TSHR

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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120136654-A Method for preparing bicyclopropyl high-energy fuel by catalyzing olefin with ionic liquid 河南大学 2025-06-13 CN claimed
CN-119977859-A Tower type extraction equipment and process for coproduction of lutein and zeaxanthin 山西三个农夫食品有限公司 2025-05-13 CN claimed
CN-119667056-A Analysis method for determining content of dihydroergotoxine mesylate bulk drug 宝利化(南京)制药有限公司 2025-03-21 CN claimed
CN-119431140-A Method for preparing dibutyl terephthalate by ionic liquid catalysis 四川化工职业技术学院 2025-02-14 CN claimed
CN-119287525-A Texturing additive, texturing liquid and use method thereof 常州时创能源股份有限公司 2025-01-10 CN claimed
CN-119009109-A Lithium hexafluorophosphate-containing electrolyte and preparation method thereof 胜华新能源科技(东营)有限公司 2024-11-22 CN claimed
CN-118978506-A Preparation method of epigallocatechin gallate alkyl derivative 湖南成大生物科技有限公司 2024-11-19 CN claimed
CN-118666701-A Preparation method of acyl amino acid surfactant 广州花语精细化工有限公司 2024-09-20 CN claimed
CN-116478058-B Production method of metolachlor 河南牧业经济学院 2024-06-25 CN claimed
CN-114843496-B Silicon-based anode material and preparation method and application thereof 蜂巢能源科技股份有限公司 2024-06-14 CN claimed
CN-114133501-A Preparation method of high-water-vapor adsorption polymer ionic gel 中国科学院大连化学物理研究所 2022-03-04 CN claimed
CN-113772792-A Magnetic control nanometer motor overflows adsorption reaction subassembly 昆明理工大学 2021-12-10 CN claimed
CN-113733693-A Preparation method of stock solution coloring chlorine-bleaching-resistant surgical gown fabric 潍坊迅纺新材料科技有限公司 2021-12-03 CN claimed
CN-113426490-A Method for preparing mercury-free catalyst by adding dichloroethane 宁夏新龙蓝天科技股份有限公司 2021-09-24 CN claimed
CN-110297020-B Preparation method of calcium-doped silicon nitride graphene paste electrode sensor 济南大学 2021-05-04 CN claimed
CN-109942755-B Synthetic method of cellulose-based ionic liquid self-repairing gel 厦门大学 2020-09-18 CN claimed
CN-111635592-A Cable composite material for engineering equipment and preparation method and application thereof 安徽建筑大学 2020-09-08 CN claimed
CN-107394215-B Preparation and application of heteroatom-doped functional carbon material 西北师范大学 2020-07-21 CN claimed
CN-110819445-A Method for removing polycyclic aromatic hydrocarbon from grease 丰益(上海)生物技术研发中心有限公司 2020-02-21 CN claimed
CN-102633625-A Preparation method of fluorocinnamic acid HUBEI YUANCHENG PHARMACEUTICAL 2012-08-15 CN claimed