SCHEMBL7273286

SCHEMBL7273286

O=C(C[C@@H](Cc1cccc2ccccc12)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1)N1CCN(c2ccccc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP2C19 P33261 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
OPRK1 P41145 1/20 0.39
GRM5 P41594 1/20 0.38
GFER P55789 1/20 0.37
POLB P06746 3/20 0.37
PPARA Q07869 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL7273674 0.92 DPP4 (0.40) MAPTKDM4EALDH1A1SMN1; SMN2PPARA
SCHEMBL7273664 0.92 DPP4 (0.40) MAPTKDM4EALDH1A1SMN1; SMN2PPARA
SCHEMBL7288366 0.92 PPARA (0.38) KDM4EALDH1A1GAAOPRK1PPARA
SCHEMBL7287672 0.91 PPARA (0.39) KDM4EALDH1A1HSD17B10PPARAKMT2A
SCHEMBL7291357 0.91 PPARA (0.38) KDM4EALDH1A1CYP3A4GAAOPRK1
SCHEMBL7288445 0.89 PPARA (0.37) KDM4EPPARAKMT2AMEN1
SCHEMBL7292195 0.85 KMT2A (0.39) CYP2C19SMN1; SMN2POLBPPARAKMT2A
SCHEMBL7312186 0.82 PPARA (0.42) PPARAKMT2A
SCHEMBL7273333 0.81 CASP1 (0.40) MAPTKDM4ECYP3A4PPARANPC1
SCHEMBL7296207 0.81 PPARA (0.41) KDM4EALDH1A1CYP3A4CYP1A2POLB

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 3 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-B1 New renin-inhibitory oligopeptides, their preparaton and their use SANKYO CO (JP) 1994-02-16 EP disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 EP disclosed