SCHEMBL7842480

SCHEMBL7842480

CS(=O)(=O)c1ccccc1-c1sc(-c2ccccc2Cl)nc1-c1ccc(F)cc1F

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 12/20 0.74
PTGS1 P23219 2/20 0.74
HSD11B1 P28845 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 1/20 0.38
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
ALOX5 P09917 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
SCHEMBL7840353 0.92 PTGS2 (0.63) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7842585 0.90 PTGS2 (0.72) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7843832 0.86 PTGS2 (0.59) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7833474 0.86 PTGS2 (0.76) PTGS2PTGS1MAPTALOX5
SCHEMBL7842478 0.85 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL7840964 0.85 PTGS2 (0.76) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7833088 0.82 PTGS2 (0.55) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7844755 0.81 PTGS2 (0.72) PTGS2PTGS1HSD11B1L3MBTL1MAPT
SCHEMBL7844796 0.81 PTGS2 (0.56) PTGS2PTGS1HSD11B1L3MBTL1ALOX5AP
SCHEMBL7831967 0.79 PTGS2 (0.81) PTGS2PTGS1

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