SCHEMBL7290361

SCHEMBL7290361

O=C(C[C@@H](Cc1cccc2ccccc12)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1)NCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.41
PPARA Q07869 1/20 0.40
PTPN1 P18031 1/20 0.39
PSMB8 P28062 1/20 0.37
HPGD P15428 2/20 0.36
MCL1 Q07820 1/20 0.36
CASP1 P29466 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
BRS3 P32247 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL7287579 0.92 PPARA (0.45) MEN1KMT2ALMNAPPARAPSMB8
SCHEMBL7312186 0.92 PPARA (0.42) KMT2APPARAPSMB8SIGMAR1HRH4
SCHEMBL7296207 0.83 PPARA (0.41) MEN1KMT2APPARAPSMB8KDM4E
SCHEMBL7273339 0.83 CASP1 (0.40) MEN1KMT2APPARACASP1HRH4
SCHEMBL7273333 0.83 CASP1 (0.40) MEN1KMT2APPARACASP1HRH4
SCHEMBL7288366 0.83 PPARA (0.38) MEN1KMT2APPARAHPGDSIGMAR1
SCHEMBL7291357 0.82 PPARA (0.38) MEN1KMT2APPARAHPGDHRH4
SCHEMBL7273664 0.81 DPP4 (0.40) MEN1KMT2APPARAHPGDKDM4E
SCHEMBL7273674 0.81 DPP4 (0.40) MEN1KMT2APPARAHPGDKDM4E
SCHEMBL7287672 0.81 PPARA (0.39) MEN1KMT2APPARACASP1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5378690-A Treatment of angiotensin induced hypertension SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 EP disclosed