SCHEMBL7843877

SCHEMBL7843877

Cc1csc(-c2sc(-c3ccccc3Cl)nc2-c2cccc(F)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.61
PTGS1 P23219 2/20 0.46
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39
RXFP1 Q9HBX9 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
TRPM8 Q7Z2W7 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7842651 0.89 PTGS2 (0.59) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7843825 0.89 PTGS2 (0.55) PTGS2PTGS1CYP1A1CYP1A2CYP1B1
SCHEMBL7842150 0.85 PTGS2 (0.51) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7844544 0.85 PTGS2 (0.45) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7843838 0.85 PTGS2 (0.60) PTGS2PTGS1ALDH1A1MAPTKMT2A
SCHEMBL7832883 0.84 PTGS2 (0.55) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7832430 0.84 PTGS2 (0.50) PTGS2PTGS1CYP1A1CYP1A2CYP1B1
SCHEMBL7846290 0.84 PTGS2 (0.49) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7846621 0.83 PTGS2 (0.60) PTGS2PTGS1RXFP1KDM4EALDH1A1
SCHEMBL7846633 0.82 PTGS2 (0.43) PTGS2PTGS1RXFP1KDM4EALDH1A1

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