SCHEMBL1152247

SCHEMBL1152247

O=CC1(c2ccccc2)CCCC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.47
DPP4 P27487 1/20 0.42
HDAC4 P56524 2/20 0.41
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
CYP2B6 P20813 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
PRCP P42785 1/20 0.39
SLC6A3 Q01959 1/20 0.39
GRIN1 Q05586 1/20 0.39
KCNH2 Q12809 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
Hydrochloric Acid SCHEMBL28579273 0.98 AKR1C1 (0.45) AKR1C1DPP4HDAC4GRIN2DGRIN3B
SCHEMBL1299548 0.98 AKR1C1 (0.45) AKR1C1DPP4HDAC4GRIN2DGRIN3B
Hydrochloric Acid SCHEMBL28583230 0.96 OPRM1 (0.44) AKR1C1HDAC4GRIN2DGRIN3BCYP2B6
SCHEMBL1553 0.95 AKR1C1 (0.42) AKR1C1DPP4HDAC4
Hydrochloric Acid SCHEMBL28589025 0.93 AKR1C1 (0.41) AKR1C1DPP4HDAC4
SCHEMBL568885 0.91 MEN1 (0.41) AKR1C1DPP4HDAC4
Hydrochloric Acid SCHEMBL28581691 0.88 MEN1 (0.40) AKR1C1
SCHEMBL29002067 0.86 SLC6A2 (0.50) AKR1C1SLC6A2SLC6A4SLC6A3
SCHEMBL3885322 0.83 MEN1 (0.36) AKR1C1DPP4HDAC4
SCHEMBL11703045 0.81 MEN1 (0.59) AKR1C1

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-116514800-A Preparation method of penehyclidine hydrochloride 湖南一格制药有限公司 2023-08-01 CN claimed
CN-116420575-A Stemona seed direct seeding cultivation method 重庆市中药研究院 2023-07-14 CN claimed
CN-116046945-A Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2023-05-02 CN claimed
CN-112759587-B 3- (dimethylamino methyl) piperidine-4-alcohol derivative and preparation method and pharmaceutical application thereof 复旦大学 2022-12-30 CN claimed
CN-112759587-A 3- (dimethylamino methyl) piperidine-4-alcohol derivative and preparation method and pharmaceutical application thereof 复旦大学 2021-05-07 CN claimed
CN-111333899-A Preparation method of high-compression-strength cellulose aerogel 江西理工大学 2020-06-26 CN claimed
CN-105753682-B A kind of preparation method of phenylcyclopentyl ketone 中国科学院成都有机化学有限公司 2018-01-09 CN claimed
CN-106431832-A Alpha-cyclopentyl (phenyl) methanol synthesis and resolution method 陈永军 2017-02-22 CN claimed
CN-105753682-A Preparation method of cyclopentyl phenyl ketone 中国科学院成都有机化学有限公司 2016-07-13 CN claimed
CN-104237392-A Method of detecting impurities in penehyclidine CHONGQING XIANYANG MEDICINE SCIENCE & TECHNOLOGY CO LTD 2014-12-24 CN claimed
US-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-07-15 US claimed
WO-2008121074-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-10-09 WO claimed
EP-0469887-B1 Acetamide derivatives ZENECA LTD (GB) 1994-12-14 EP claimed
EP-0469887-A1 Acetamide derivatives ZENECA LIMITED (GB) 1992-02-05 EP claimed
CN-116046945-B Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2025-03-11 CN disclosed
CN-118619939-A Synthesis method of penehyclidine hydrochloride 国药集团工业有限公司廊坊分公司 2024-09-10 CN disclosed
CN-118388328-A Method for synthesizing aldehyde ketone compound through catalyst-free photochemical decarboxylation 齐鲁工业大学(山东省科学院) 2024-07-26 CN disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed
US-4131623-A FROM DIHYDRO-1,3-OXAZINES, DECYCLIZATION BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL & MECHANICAL COLLEGE (US) 1978-12-26 US 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 (1 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-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE TDO2, AOX1, DAO AKR1C1 766/4885DPP4 1636/4885HDAC4 1548/4885

“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.