SCHEMBL7832430

SCHEMBL7832430

Cc1csc(-c2sc(-c3ccccc3Cl)nc2-c2ccc(Cl)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.50
PTGS1 P23219 2/20 0.45
APEX1 P27695 1/20 0.43
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
KDM4E B2RXH2 1/20 0.40
FABP4 P15090 1/20 0.39
CNR1 P21554 2/20 0.38
CNR2 P34972 1/20 0.38
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP1B1 Q16678 1/20 0.36
MEN1 O00255 1/20 0.36
PPARG P37231 1/20 0.36
KMT2A Q03164 1/20 0.36
NCOA2 Q15596 1/20 0.36

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
SCHEMBL7842150 0.94 PTGS2 (0.51) PTGS2PTGS1APEX1LMNAALDH1A1
SCHEMBL7843825 0.93 PTGS2 (0.55) PTGS2PTGS1LMNAALDH1A1RXFP1
SCHEMBL7846290 0.92 PTGS2 (0.49) PTGS2PTGS1APEX1LMNAALDH1A1
SCHEMBL7842651 0.91 PTGS2 (0.59) PTGS2PTGS1APEX1LMNAALDH1A1
SCHEMBL7844544 0.89 PTGS2 (0.45) PTGS2PTGS1LMNAALDH1A1RXFP1
SCHEMBL7844839 0.89 PTGS2 (0.49) PTGS2PTGS1ALDH1A1RXFP1KDM4E
SCHEMBL7846621 0.86 PTGS2 (0.60) PTGS2PTGS1LMNAALDH1A1RXFP1
SCHEMBL7839678 0.86 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7846633 0.86 PTGS2 (0.43) PTGS2PTGS1LMNAALDH1A1RXFP1
SCHEMBL7843877 0.84 PTGS2 (0.61) PTGS2PTGS1ALDH1A1RXFP1KDM4E

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