SCHEMBL7843373

SCHEMBL7843373

NS(=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
ALOX5 P09917 1/20 0.43
PTGS2 P35354 1/20 0.43
CCNA2 P20248 3/20 0.43
CDK2 P24941 3/20 0.43
CSNK2A1 P68400 1/20 0.42
F2 P00734 4/20 0.41
PRSS1 P07477 4/20 0.41
PRSS2 P07478 4/20 0.41
PRSS3 P35030 4/20 0.41
F10 P00742 2/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 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
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
CDC25A P30304 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
SCHEMBL7845455 0.91 PTGDR2 (0.46) PTGDR2ALOX5PTGS2CCNA2CDK2
SCHEMBL7839772 0.90 PTGDR2 (0.48) PTGDR2ALOX5PTGS2CCNA2CDK2
SCHEMBL7833262 0.87 DHODH (0.46) PTGDR2PTGS2MEN1KMT2ACDC25B
SCHEMBL7843369 0.86 CCNA2 (0.52) PTGDR2ALOX5PTGS2CCNA2CDK2
SCHEMBL7845452 0.80 PTGS2 (0.54) PTGDR2PTGS2
SCHEMBL7832496 0.80 KMT2A (0.51) PTGDR2ALOX5PTGS2CCNA2CDK2
SCHEMBL7847205 0.79 PTGS2 (0.47) PTGDR2PTGS2CDC25BALDH1A1MAPT
SCHEMBL7843978 0.79 KDM4E (0.48) PTGDR2PTGS2MEN1KMT2AALDH1A1
SCHEMBL7839771 0.74 CA1 (0.54) PTGDR2PTGS2CCNA2CDK2MEN1
SCHEMBL7833260 0.74 PTGS2 (0.53) PTGS2CCNA2CDK2MEN1KMT2A

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