SCHEMBL7842469

SCHEMBL7842469

CS(=O)(=O)c1ccccc1-c1sc(C(=O)NCc2ccc(F)cc2)nc1-c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.47
PTGS2 P35354 7/20 0.46
RXFP1 Q9HBX9 1/20 0.43
ALOX5 P09917 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HPGD P15428 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
SCHEMBL7841078 0.97 PTGS2 (0.48) MAOBPTGS2RXFP1ALOX5L3MBTL1
SCHEMBL7847000 0.96 PTGS2 (0.46) MAOBPTGS2RXFP1MAPTLMNA
SCHEMBL7843760 0.95 PTGS2 (0.45) MAOBPTGS2RXFP1ALOX5L3MBTL1
SCHEMBL7841881 0.95 PTGS2 (0.46) MAOBPTGS2RXFP1MAPTALDH1A1
SCHEMBL7832865 0.93 PTGS2 (0.44) MAOBPTGS2ALOX5L3MBTL1MAPT
SCHEMBL7846159 0.92 MAOB (0.47) MAOBPTGS2RXFP1L3MBTL1MAPT
SCHEMBL7842485 0.92 MAOB (0.50) MAOBPTGS2ALOX5
SCHEMBL7844201 0.91 PTGS2 (0.43) MAOBPTGS2ALOX5MAPT
SCHEMBL7844809 0.89 MAOB (0.48) MAOBPTGS2MAPT
SCHEMBL7844759 0.89 THRB (0.43) MAOBPTGS2RXFP1ALOX5LMNA

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