SCHEMBL7842622

SCHEMBL7842622

NS(=O)(=O)c1ccc(-c2nc(NC(=O)c3ccc(Br)cc3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.55
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 7/20 0.52
KMT2A Q03164 4/20 0.52
HPGD P15428 2/20 0.52
MAPT P10636 5/20 0.51
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 2/20 0.50
PTGS1 P23219 2/20 0.50
NPC1 O15118 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
RECQL P46063 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
THRB P10828 1/20 0.48
XIAP P98170 1/20 0.48
MAOA P21397 1/20 0.48
PIK3CD O00329 1/20 0.47
PIK3CA P42336 1/20 0.47
PIK3CB P42338 1/20 0.47

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
SCHEMBL7840988 1.00 PTGS2 (0.55) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7842901 0.95 SMN1; SMN2 (0.56) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7840997 0.95 SMN1; SMN2 (0.56) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7833648 0.90 MAPT (0.57) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7841748 0.90 PTGS2 (0.56) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7842145 0.90 MAPT (0.57) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7844500 0.90 PTGS2 (0.56) PTGS2LMNASMN1; SMN2KMT2AHPGD
SCHEMBL7843934 0.90 SMN1; SMN2 (0.58) PTGS2SMN1; SMN2KMT2AHPGDMAPT
SCHEMBL7832857 0.90 SMN1; SMN2 (0.58) PTGS2SMN1; SMN2KMT2AHPGDMAPT
SCHEMBL7843582 0.88 PTGS2 (0.49) PTGS2LMNASMN1; SMN2KMT2AHPGD

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