SCHEMBL8235804

SCHEMBL8235804

CCc1sc(CCCOC)cc1CN(C(=O)C1CNCC(C(=O)NC2(c3ccccc3)CCCC2)C1)C1CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.44
KCNH2 Q12809 6/20 0.40
CYP3A4 P08684 3/20 0.40
SSTR4 P31391 1/20 0.37

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
SCHEMBL1911398 1.00 REN (0.44) RENKCNH2CYP3A4SSTR4
SCHEMBL89657 1.00 REN (0.44) RENKCNH2CYP3A4SSTR4
SCHEMBL89153 0.86 REN (0.34) RENKCNH2CYP3A4
SCHEMBL89758 0.79 REN (0.51) RENKCNH2CYP3A4
SCHEMBL8238285 0.79 REN (0.51) RENKCNH2CYP3A4
SCHEMBL89468 0.78 REN (0.72) RENKCNH2
SCHEMBL89261 0.78 REN (0.61) RENKCNH2
SCHEMBL8235595 0.78 REN (0.52) RENKCNH2CYP3A4SSTR4
SCHEMBL90113 0.78 REN (0.52) RENKCNH2CYP3A4SSTR4
SCHEMBL89939 0.76 REN (0.44) RENKCNH2CYP3A4SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 WO disclosed