SCHEMBL8797124

SCHEMBL8797124

CCc1cccc(CC)c1NC(=O)C1c2cc(Br)ccc2OCc2cccc(C)c21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.41
POLB P06746 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
RAB9A P51151 1/20 0.39
HTT P42858 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TBXA2R P21731 1/20 0.36
THRB P10828 1/20 0.35
MAPT P10636 2/20 0.35
ROCK2 O75116 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 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
SCHEMBL8797675 0.87 HTT (0.43) TP53HTTTBXA2RTHRBMAPT
SCHEMBL8797665 0.81 TBXA2R (0.38) TDP1RAB9ATBXA2RMAPTMAPK1
SCHEMBL8797278 0.78 TP53 (0.41) TP53POLBTDP1RAB9AHTT
SCHEMBL8797849 0.78 TP53 (0.44) TP53POLBTDP1RAB9AHTT
SCHEMBL8798200 0.77 TP53 (0.48) TP53POLBTDP1RAB9AHTT
SCHEMBL8797149 0.76 HTT (0.41) TP53POLBTDP1RAB9AHTT
SCHEMBL8797662 0.74 LPAR1 (0.46) TP53TDP1MEN1KMT2ASMN1; SMN2
SCHEMBL8797142 0.74 HTT (0.42) TP53POLBTDP1RAB9AHTT
SCHEMBL8797482 0.73 LPAR1 (0.45) TP53POLBTDP1RAB9AMEN1
SCHEMBL8797886 0.72 LPAR1 (0.42) TP53TDP1KMT2ASMN1; SMN2TBXA2R

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