SCHEMBL7288366

SCHEMBL7288366

O=C(C[C@@H](Cc1cccc2ccccc12)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1)N1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
DPP4 P27487 2/20 0.36
KDM4E B2RXH2 2/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
OPRK1 P41145 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TACR1 P25103 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
CLPP Q16740 1/20 0.34
CTNNB1 P35222 1/20 0.34
SIGMAR1 Q99720 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
SCHEMBL7291357 0.99 PPARA (0.38) PPARAKMT2AMEN1DPP4KDM4E
SCHEMBL7273674 0.93 DPP4 (0.40) PPARAKMT2AMEN1DPP4KDM4E
SCHEMBL7273664 0.93 DPP4 (0.40) PPARAKMT2AMEN1DPP4KDM4E
SCHEMBL7288445 0.92 PPARA (0.37) PPARAKMT2AMEN1DPP4KDM4E
SCHEMBL7287672 0.92 PPARA (0.39) PPARAKMT2AMEN1DPP4KDM4E
SCHEMBL7273286 0.92 MAPT (0.41) PPARAKMT2AMEN1KDM4EGAA
SCHEMBL7292195 0.88 KMT2A (0.39) PPARAKMT2AMEN1TACR1
SCHEMBL7312186 0.85 PPARA (0.42) PPARAKMT2ATACR1HRH4CLPP
SCHEMBL7296207 0.84 PPARA (0.41) PPARAKMT2AMEN1KDM4EALDH1A1
SCHEMBL7273333 0.84 CASP1 (0.40) PPARAKMT2AMEN1KDM4ETACR1

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