SCHEMBL7844775

SCHEMBL7844775

CS(=O)(=O)c1ccccc1-c1sc(-c2ccccc2Cl)nc1-c1cccs1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.74
PTGS1 P23219 2/20 0.46
HSD11B1 P28845 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 3/20 0.39
HTT P42858 2/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL7843832 0.88 PTGS2 (0.59) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7842779 0.85 PTGS2 (1.00) PTGS2PTGS1HSD11B1
SCHEMBL7841914 0.84 PTGS2 (0.55) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7844755 0.84 PTGS2 (0.72) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7833088 0.83 PTGS2 (0.55) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7845047 0.82 PTGS2 (0.66) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7842585 0.82 PTGS2 (0.72) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7833463 0.81 PTGS2 (0.65) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7840911 0.81 PTGS2 (0.65) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1
SCHEMBL7845601 0.81 PTGS2 (0.77) PTGS2PTGS1HSD11B1L3MBTL1ALDH1A1

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 2 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