SCHEMBL9237169

SCHEMBL9237169

CCCCCCc1cccc2sc(SN)nc12

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.47
TLR8 Q9NR97 9/20 0.41
KCNH2 Q12809 2/20 0.41
LIPG Q9Y5X9 1/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36
KAT8 Q9H7Z6 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
EP300 Q09472 1/20 0.36
KAT2A Q92830 1/20 0.36
KAT2B Q92831 1/20 0.36
KAT5 Q92993 1/20 0.36
SAE1 Q9UBE0 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
SCHEMBL28701435 1.00 PTGS2 (0.47) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL23174999 1.00 PTGS2 (0.47) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL28375837 1.00 PTGS2 (0.47) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL2671226 0.99 PTGS2 (0.45) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL583151 0.94 PTGS2 (0.41) PTGS2TLR8KCNH2HSP90AA1HSP90AB1
SCHEMBL30305194 0.94 PTGS2 (0.41) PTGS2TLR8KCNH2HSP90AA1HSP90AB1
SCHEMBL29437643 0.83 PTGS2 (0.44) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL28359937 0.83 PTGS2 (0.44) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL29494843 0.83 PTGS2 (0.44) PTGS2TLR8KCNH2LIPGHSP90AA1
SCHEMBL28299064 0.83 MEN1 (0.47) TLR8

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300424-A1 Vulcanization accelerators THE B.F. GOODRICH COMPANY (US) 1989-01-25 EP claimed
EP-0109955-B1 RUBBER/METAL COMPOSITES MONSANTO EUROPE S.A./N.V. (BE) 1988-01-20 EP claimed
CN-108473766-A Polyarylene sulfide resin composition and molded article SK化学株式会社 2018-08-31 CN disclosed
CN-108463485-A polyarylene sulfide resin and preparation method thereof SK化学株式会社 2018-08-28 CN disclosed
WO-2014012979-A2 LATEX COMPOSITION SOBELTEC (BE) 2014-01-23 WO disclosed
WO-1995016738-A1 ELECTRONEGATIVE-SUBSTITUTED BISMALEIMIDE ANTI-REVERSION COAGENTS AKZO NOBEL N.V. (NL) 1995-06-22 WO disclosed
EP-0389144-A2 Ethylene-olefin rubbery copolymers and composition thereof for use as sponge rubber SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-09-26 EP disclosed
EP-0300424-A1 Vulcanization accelerators THE B.F. GOODRICH COMPANY (US) 1989-01-25 EP disclosed
EP-0300424-A1 Vulcanization accelerators THE B.F. GOODRICH COMPANY (US) 1989-01-25 EP disclosed
EP-0109955-B1 RUBBER/METAL COMPOSITES MONSANTO EUROPE S.A./N.V. (BE) 1988-01-20 EP disclosed
EP-0109955-A2 Rubber/metal composites MONSANTO EUROPE S.A./N.V. (BE) 1984-05-30 EP disclosed