SCHEMBL7843825

SCHEMBL7843825

Cc1csc(-c2sc(-c3ccccc3Cl)nc2-c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.55
RXFP1 Q9HBX9 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PTGS1 P23219 2/20 0.44
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
CYP1A1 P04798 3/20 0.40
CYP1B1 Q16678 3/20 0.40
CYP1A2 P05177 2/20 0.40
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
NR4A2 P43354 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
SCHEMBL7842150 0.94 PTGS2 (0.51) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7832430 0.93 PTGS2 (0.50) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7846290 0.92 PTGS2 (0.49) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7844544 0.91 PTGS2 (0.45) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7842651 0.91 PTGS2 (0.59) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7844839 0.89 PTGS2 (0.49) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7843877 0.89 PTGS2 (0.61) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7846621 0.89 PTGS2 (0.60) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7846633 0.88 PTGS2 (0.43) PTGS2RXFP1ALDH1A1KDM4EPTGS1
SCHEMBL7839678 0.86 PTGS2 (0.65) PTGS2PTGS1

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