SCHEMBL7842485

SCHEMBL7842485

CS(=O)(=O)c1ccccc1-c1sc(C(=O)NCc2cccc(F)c2)nc1-c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
ROCK2 O75116 1/20 0.47
PTGS2 P35354 7/20 0.43
RORC P51449 1/20 0.42
CHRM4 P08173 1/20 0.41
HMGCR P04035 1/20 0.41
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
THRB P10828 1/20 0.40
SRC P12931 1/20 0.40
USP7 Q93009 1/20 0.40
ALOX5 P09917 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
SCHEMBL7843454 0.93 MAOB (0.50) MAOBROCK2PTGS2CHRM4ADORA2A
SCHEMBL7832865 0.93 PTGS2 (0.44) MAOBROCK2PTGS2RORCALOX5
SCHEMBL7841078 0.93 PTGS2 (0.48) MAOBPTGS2ALOX5
SCHEMBL7844809 0.92 MAOB (0.48) MAOBPTGS2RORC
SCHEMBL7844759 0.92 THRB (0.43) MAOBROCK2PTGS2RORCCHRM4
SCHEMBL7842469 0.92 MAOB (0.47) MAOBPTGS2ALOX5
SCHEMBL7844201 0.88 PTGS2 (0.43) MAOBPTGS2RORCALOX5
SCHEMBL7847000 0.88 PTGS2 (0.46) MAOBPTGS2
SCHEMBL7843760 0.87 PTGS2 (0.45) MAOBPTGS2ALOX5
SCHEMBL7841881 0.87 PTGS2 (0.46) MAOBPTGS2

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