SCHEMBL3719230

SCHEMBL3719230

Cc1c(O)ccc(S)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.40
ATM Q13315 1/20 0.40
TP53 P04637 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
SCN5A Q14524 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
ACHE P22303 1/20 0.33
ESR1 P03372 6/20 0.32
ESR2 Q92731 6/20 0.32
AR P10275 2/20 0.32
TYR P14679 1/20 0.32
ALOX15 P16050 2/20 0.32
HSD17B10 Q99714 2/20 0.32
PDE10A Q9Y233 1/20 0.32
RPS6KA3 P51812 1/20 0.32
MAOB P27338 1/20 0.31

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
SCHEMBL29457565 0.82 TRPA1 (0.53) TRPA1ATMTP53TDP1KDM4E
SCHEMBL68013 0.82 TRPA1 (0.53) TRPA1ATMTP53TDP1KDM4E
SCHEMBL28105930 0.82 ACHE (0.33) TDP1ACHE
SCHEMBL28460155 0.81 TRPA1 (0.39) TRPA1ATMTP53TDP1KDM4E
Methane SCHEMBL27535749 0.78 TRPA1 (0.50) TRPA1ATMTP53TDP1KDM4E
SCHEMBL10934865 0.77 ALDH1A1 (0.38) TRPA1ATMTP53TDP1MAPK1
SCHEMBL14157765 0.77 TRPA1 (0.36) TRPA1ATMTP53TDP1KDM4E
SCHEMBL1200394 0.76
SCHEMBL27624595 0.74 TRPA1 (0.42) TRPA1ATMTP53TDP1KDM4E
SCHEMBL2475582 0.74 ALDH1A1 (0.35) TRPA1ATMTDP1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640590-A1 Process for the synthesis of 4-mercaptophenols and naphthalenols Bristol-Myers Company (US) 1995-03-01 EP claimed
EP-0482342-A2 Hypocholesterolemic unsymmetrical dithiol ketals Bristol-Myers Squibb Company (US) 1992-04-29 EP claimed
CN-119317999-A Method for processing component 日东电工株式会社 2025-01-14 CN disclosed
CN-119301209-A Transfer sheet 日东电工株式会社 2025-01-10 CN disclosed
CN-118946340-A Curable composition for dentistry having excellent color tone adaptability 可乐丽则武齿科株式会社 2024-11-12 CN disclosed
CN-114929158-B Method for producing denture, curable composition for photoforming, and kit for producing denture 株式会社德山齿科 2023-10-20 CN disclosed
CN-102112452-B Compound with agonism on delta subtype peroxidase proliferator activated receptor, preparation method and application thereof ZHEJIANG HISUN PHARMACEUTICAL 2014-05-14 CN disclosed
EP-1930396-B1 Furochroman derivatives MERCK PATENT GMBH (DE) 2011-07-06 EP disclosed
CN-102112452-A Compound with agonism on delta subtype peroxidase proliferator activated receptor, preparation method and application thereof ZHEJIANG HISUN PHARMACEUTICAL 2011-06-29 CN disclosed
WO-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed
EP-1422254-B1 Photocationic polymerization initiator and photocationically polymerizable composition TOKUYAMA CORP (JP) 2008-06-18 EP disclosed
US-20040132853-A1 Photocationic polymerization initiator and photocationically polymerizable composition TOKUYAMA CORPORATION (JP) 2004-07-08 US disclosed
EP-1431315-A2 Photopolymerization initiator and photopolymerizable composition Tokuyama Corporation (JP) 2004-06-23 EP disclosed
EP-1422254-A2 Photocationic polymerization initiator and photocationically polymerizable composition Tokuyama Corporation (JP) 2004-05-26 EP disclosed
EP-0640590-A1 Process for the synthesis of 4-mercaptophenols and naphthalenols Bristol-Myers Company (US) 1995-03-01 EP disclosed
US-5321046-A Hypocholesterolemic unsymmetrical dithiol ketals BRISTOL-MYERS SQUIBB COMPANY (US) 1994-06-14 US disclosed
EP-0482342-A2 Hypocholesterolemic unsymmetrical dithiol ketals Bristol-Myers Squibb Company (US) 1992-04-29 EP disclosed
EP-0361682-A1 Halomethyl-1,3,5-triazines containing a photoinitiator moiety MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-04-04 EP disclosed
US-4064158-A Process for the preparation of an organomercaptophenol from sulfur, a 2,6-disubstituted phenol, and an activated olefin or an epoxy compound GENERAL ELECTRIC COMPANY (US) 1977-12-20 US disclosed
US-3979460-A ANTIOXIDANTS GENERAL ELECTRIC COMPANY (US) 1976-09-07 US disclosed