SCHEMBL7287672

SCHEMBL7287672

CN1CCN(C(=O)C[C@@H](Cc2cccc3ccccc23)C(=O)N2C(=O)OC[C@@H]2Cc2ccccc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.39
KMT2A Q03164 2/20 0.38
DPP4 P27487 2/20 0.38
HSD17B10 Q99714 2/20 0.37
CHRM1 P11229 3/20 0.37
KDM4E B2RXH2 2/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
MEN1 O00255 1/20 0.35
TACR1 P25103 1/20 0.35
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CCKBR P32239 1/20 0.34
CTSB P07858 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
SCHEMBL7288366 0.92 PPARA (0.38) PPARAKMT2ADPP4KDM4EAPOBEC3A
SCHEMBL7291357 0.92 PPARA (0.38) PPARAKMT2ADPP4KDM4EAPOBEC3A
SCHEMBL7273286 0.91 MAPT (0.41) PPARAKMT2AHSD17B10KDM4EMEN1
SCHEMBL7273674 0.91 DPP4 (0.40) PPARAKMT2ADPP4KDM4EMEN1
SCHEMBL7273664 0.91 DPP4 (0.40) PPARAKMT2ADPP4KDM4EMEN1
SCHEMBL7288445 0.90 PPARA (0.37) PPARAKMT2ADPP4KDM4EAPOBEC3A
SCHEMBL7292195 0.88 KMT2A (0.39) PPARAKMT2AMEN1TACR1TP53
SCHEMBL7296207 0.84 PPARA (0.41) PPARAKMT2ACHRM1KDM4EMEN1
SCHEMBL7312186 0.83 PPARA (0.42) PPARAKMT2ATACR1
SCHEMBL7273333 0.82 CASP1 (0.40) PPARAKMT2AKDM4EMEN1TACR1

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