SCHEMBL8797221

SCHEMBL8797221

Cc1cc(Cl)c2c(c1C)C(C(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1CO2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 2/20 0.36
S1PR4 O95977 1/20 0.36
S1PR5 Q9H228 1/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LPAR1 Q92633 2/20 0.35
RAB9A P51151 1/20 0.35
ROCK2 O75116 3/20 0.35
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL8797517 0.89 KMT2A (0.38) KMT2AALDH1A1TP53S1PR4S1PR5
SCHEMBL8797985 0.86 NLRP3 (0.35) KMT2AALDH1A1S1PR4S1PR5LMNA
SCHEMBL8797868 0.84 KMT2A (0.40) KMT2ATP53LMNASMN1; SMN2LPAR1
SCHEMBL8797512 0.81 ALDH1A1 (0.37) KMT2AALDH1A1RAB9A
SCHEMBL8797727 0.81 TP53 (0.49) KMT2ATP53LMNASMN1; SMN2LPAR1
SCHEMBL8797543 0.80 TP53 (0.39) KMT2AALDH1A1TP53LMNASMN1; SMN2
SCHEMBL8797529 0.79 TP53 (0.46) KMT2AALDH1A1TP53LMNASMN1; SMN2
SCHEMBL8797371 0.78 TP53 (0.42) KMT2ATP53LMNASMN1; SMN2LPAR1
SCHEMBL8798206 0.77 NLRP3 (0.37) KMT2AALDH1A1S1PR4S1PR5LMNA
SCHEMBL8797541 0.77 LPAR1 (0.45) KMT2AALDH1A1TP53S1PR4S1PR5

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 7 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 claimed
US-5340807-A Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-08-23 US claimed
EP-0497201-A1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-08-05 EP claimed
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