SCHEMBL7274947

SCHEMBL7274947

O=C(C[C@@H](Cc1ccccc1)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.44
PPARA Q07869 2/20 0.41
AVPR1A P37288 1/20 0.39
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ABCC3 O15438 1/20 0.36
NR1I2 O75469 1/20 0.36
ABCB11 O95342 1/20 0.36
NR3C1 P04150 1/20 0.36
RARG P13631 1/20 0.36
CNR1 P21554 1/20 0.36
OPRK1 P41145 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 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
SCHEMBL7274942 1.00 SLC15A1 (0.44) SLC15A1PPARAAVPR1AALDH1A1MAPK1
SCHEMBL7273339 0.88 CASP1 (0.40) SLC15A1PPARACYP3A4HRH4NPC1
SCHEMBL7273333 0.88 CASP1 (0.40) SLC15A1PPARACYP3A4HRH4NPC1
SCHEMBL28887254 0.87 CPA1 (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL17447919 0.87 CPA1 (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL6332671 0.87 CPA1 (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL28389952 0.87 CPA1 (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL28887255 0.87 CPA1 (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL13103440 0.87 PPARA (0.47) PPARACYP1A2IL6STFAAHNAAA
SCHEMBL21978244 0.86 PPARA (0.41) PPARAIL6STFAAHNAAA

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
EP-0383635-B1 Peptides having renin inhibitory activity their preparation and use SANKYO CO (JP) 1995-07-12 EP disclosed
US-5378689-A Hypotensive agents; administrable by mouth SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
EP-0383635-A2 Peptides having renin inhibitory activity their preparation and use Sankyo Company Limited (JP) 1990-08-22 EP disclosed