SCHEMBL4755175

SCHEMBL4755175

CNCC(C)N(C(=O)N1CCCC(N(CCCNC(=O)OC)c2cccc(Cl)c2)C1)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.48
CYP3A4 P08684 3/20 0.45

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
SCHEMBL4755808 1.00 REN (0.48) RENCYP3A4
SCHEMBL2998810 0.84 REN (0.69) RENCYP3A4
SCHEMBL2996644 0.84 REN (0.69) RENCYP3A4
SCHEMBL3001492 0.84 REN (0.43) RENCYP3A4
SCHEMBL3001819 0.82 REN (0.44) RENCYP3A4
SCHEMBL4755184 0.82 REN (0.48) RENCYP3A4
SCHEMBL4755811 0.82 REN (0.48) RENCYP3A4
SCHEMBL4753058 0.80 REN (0.41) RENCYP3A4
SCHEMBL4753061 0.79 REN (0.48) RENCYP3A4
SCHEMBL2993303 0.78 REN (0.66) RENCYP3A4

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-2008156828-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2008-12-24 WO claimed