SCHEMBL8798337

SCHEMBL8798337

Cc1ccc2c(c1)C(C(=O)Nc1c(Cl)cccc1Cl)c1ccccc1CO2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.45
KMT2A Q03164 2/20 0.38
XIAP P98170 2/20 0.38
TBXA2R P21731 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.36
MAOB P27338 2/20 0.36
THRB P10828 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
ROCK2 O75116 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
SCHEMBL8798003 0.95 TP53 (0.45) TP53KMT2ATBXA2RALDH1A1HTT
SCHEMBL8797777 0.89 TP53 (0.52) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8797523 0.87 MAPT (0.41) TP53KMT2AXIAPTBXA2RMAPT
SCHEMBL8797272 0.87 TP53 (0.45) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8798872 0.87 TP53 (0.45) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8798069 0.87 TP53 (0.61) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8797531 0.86 TP53 (0.38) TP53XIAPTBXA2RMAPTNPSR1
SCHEMBL8797849 0.86 TP53 (0.44) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8797274 0.84 TBXAS1 (0.45) TP53KMT2ATBXA2RMAPTNPSR1
SCHEMBL8797123 0.81 TP53 (0.40) TP53KMT2AXIAPTBXA2RMAPT

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-0497201-B1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1997-01-15 EP disclosed
US-5478835-A Acyl coenzyme A: acyltransferase inhibitors; treatment of hyperlipemia and arteriosclerosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-12-26 US disclosed
US-5340807-A Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-08-23 US disclosed
EP-0497201-A1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-08-05 EP disclosed