SCHEMBL3628525

SCHEMBL3628525

CCCSc1ccccc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
POLB P06746 2/20 0.52
PTGS2 P35354 3/20 0.49
HSD17B10 Q99714 1/20 0.49
ALDH1A1 P00352 3/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
TLR8 Q9NR97 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 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
SCHEMBL28126730 0.98 MEN1 (0.52) MEN1KMT2AMAPTNPSR1APOBEC3G
Hydrochloric Acid SCHEMBL16445779 0.98 MEN1 (0.52) MEN1KMT2AMAPTNPSR1APOBEC3G
Hydrochloric Acid SCHEMBL28165340 0.96 MEN1 (0.50) MEN1KMT2AMAPTNPSR1APOBEC3G
Hydrochloric Acid SCHEMBL28165341 0.96 MEN1 (0.50) MEN1KMT2AMAPTNPSR1APOBEC3G
Aniline SCHEMBL22169097 0.92 POLB (0.50) MEN1KMT2AMAPTNPSR1APOBEC3G
SCHEMBL28165339 0.92 KMT2A (0.47) MEN1KMT2AMAPTNPSR1APOBEC3G
SCHEMBL425178 0.87 TLR8 (0.54) MEN1KMT2AMAPTNPSR1APOBEC3G
SCHEMBL10350653 0.85 PTGS2 (0.55) PTGS2ALDH1A1TLR8PDE5ASOAT1
SCHEMBL30548746 0.85 PTGS2 (0.55) PTGS2ALDH1A1TLR8PDE5ASOAT1
SCHEMBL29351476 0.85 MEN1 (0.62) MEN1KMT2AMAPTNPSR1APOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106674427-A Double active center composite catalyst and cycloolefin copolymers produced by using catalyst 中国石化扬子石油化工有限公司 2017-05-17 CN claimed
US-20230357454-A1 Methods for Delivery of Non-Aromatic Solutions to Polymerization Reactors EXXONMOBIL CHEMICAL PATENTS INC (US) 2023-11-09 US disclosed
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 EP disclosed
WO-2021083246-A1 MODIFIER OF FOUR-MEMBERED RING DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF 上海翰森生物医药科技有限公司 2021-05-06 WO disclosed
WO-2020238776-A1 SUBSTITUTED FUSED BICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINES 江苏恒瑞医药股份有限公司 2020-12-03 WO disclosed
WO-2020108613-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏豪森药业集团有限公司 2020-06-04 WO disclosed
EP-3546457-A1 PYRAZOLO-HETEROARYL DERIVATIVE, PREPARATION METHOD AND MEDICAL USE THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2019-10-02 EP disclosed
CN-106674428-B A kind of double activity center's composite catalyst and the cyclic olefine copolymer using its preparation 中国石化扬子石油化工有限公司 2019-09-06 CN disclosed
CN-106674427-B A kind of double activity center's composite catalyst and the cyclic olefine copolymer using its preparation 中国石化扬子石油化工有限公司 2019-09-06 CN disclosed
EP-3527570-A1 FIVE-MEMBERED HETEROARYL RING BRIDGED RING DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2019-08-21 EP disclosed
EP-0288519-A4 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS 1992-04-15 EP disclosed
US-4965273-A Certain 1-tertiary-butyl-naphthyridone carboxylic acid derivatives anti-bacterial agents BRISTOL-MYERS COMPANY (US) 1990-10-23 US disclosed
US-4954507-A 1-tertiary-alkyl-substituted naphthyridine carboxylic acid antibacterial agents BRISTOL-MYERS COMPANY (US) 1990-09-04 US disclosed
EP-0288519-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS Bristol-Myers Squibb Company (US) 1988-11-02 EP disclosed
EP-0266576-A2 1-Tert-alkyl-substituted naphthyridine and quinoline carboxylic acids as antibacterial agents Bristol-Myers Squibb Company (US) 1988-05-11 EP disclosed
WO-1988002627-A1 1-TERTIARY-ALKYL-SUBSTITUTED NAPHTHYRIDINE- AND QUINOLINE-CARBOXYLIC ACID ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1988-04-21 WO disclosed
EP-0201811-A1 7-Oxabicycloheptane substituted aryl amino prostaglandin analogs and their use in inhibiting platelet aggregation and bronchoconstriction E.R. Squibb & Sons, Inc. (US) 1986-11-20 EP disclosed
US-4607048-A 7-oxabicycloheptane substituted aryl amino prostaglandin analogs and their use in inhibiting platelet aggregation and bronchoconstriction E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0053015-A1 1-Phenylthio-2-aminopropane derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-06-02 EP disclosed
EP-0035893-A2 Herbicidal benzene- and pyridine-sulfonamide derivatives E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-09-16 EP disclosed