SCHEMBL7847022

SCHEMBL7847022

Cc1ccc(C(=O)Nc2nc(-c3ccc(F)cc3)c(-c3ccc(S(C)(=O)=O)cc3)s2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.60
MAPT P10636 4/20 0.58
SMN1; SMN2 Q16637 6/20 0.57
L3MBTL1 Q9Y468 2/20 0.54
USP2 O75604 1/20 0.54
PTGS1 P23219 2/20 0.54
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
HPGD P15428 2/20 0.52
PIK3CD O00329 1/20 0.52
PIK3CA P42336 1/20 0.52
PIK3CB P42338 1/20 0.52
PIK3CG P48736 1/20 0.52
RECQL P46063 1/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
THRB P10828 1/20 0.52

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
SCHEMBL7843109 1.00 PTGS2 (0.60) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7833741 0.96 PTGS2 (0.61) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7846092 0.96 PTGS2 (0.61) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7844500 0.91 PTGS2 (0.56) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7833648 0.91 MAPT (0.57) PTGS2MAPTSMN1; SMN2L3MBTL1PTGS1
SCHEMBL7842268 0.91 PTGS2 (0.65) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7841748 0.91 PTGS2 (0.56) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7842145 0.91 MAPT (0.57) PTGS2MAPTSMN1; SMN2L3MBTL1PTGS1
SCHEMBL7842479 0.91 PTGS2 (0.62) PTGS2MAPTSMN1; SMN2L3MBTL1USP2
SCHEMBL7846124 0.91 PTGS2 (0.62) PTGS2MAPTSMN1; SMN2L3MBTL1USP2

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