SCHEMBL7845455

SCHEMBL7845455

CS(=O)(=O)c1ccccc1-c1sc(Nc2cccc(C(=O)O)c2)nc1-c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.46
PTGS2 P35354 3/20 0.45
ALOX5 P09917 1/20 0.45
CSNK2A1 P68400 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
PI4KB Q9UBF8 2/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 2/20 0.41
CDC25B P30305 2/20 0.41
MAP2K7 O14733 1/20 0.41
NSD2 O96028 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
CDC25A P30304 1/20 0.41
HTT P42858 1/20 0.41
MCL1 Q07820 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL7843373 0.91 PTGDR2 (0.46) PTGDR2PTGS2ALOX5CSNK2A1MEN1
SCHEMBL7832496 0.90 KMT2A (0.51) PTGDR2PTGS2ALOX5CSNK2A1MEN1
SCHEMBL7847205 0.88 PTGS2 (0.47) PTGDR2PTGS2MAPTRAB9ACDC25B
SCHEMBL7845452 0.86 PTGS2 (0.54) PTGDR2PTGS2
SCHEMBL7846126 0.83 KMT2A (0.55) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL7846877 0.82 APEX1 (0.55) PTGDR2PTGS2ALOX5
SCHEMBL7843316 0.81 MAPT (0.48) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL7833262 0.81 DHODH (0.46) PTGDR2PTGS2MEN1KMT2AMAPT
SCHEMBL7846460 0.80 PTGDR2 (0.57) PTGDR2PTGS2ALOX5MEN1KMT2A
SCHEMBL7843369 0.80 CCNA2 (0.52) PTGDR2PTGS2ALOX5MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed