SCHEMBL15599650

SCHEMBL15599650

COc1cc([C@@H](C)N(C(=O)[C@H]2CNC[C@@H](CC#N)O2)C2CC2)cc(CCCNO)n1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.62

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
SCHEMBL17013117 0.93 REN (0.72) REN
SCHEMBL15599618 0.88 REN (0.68) REN
SCHEMBL17013108 0.84 REN (0.76) REN
SCHEMBL15599638 0.83 REN (0.64) REN
SCHEMBL17013764 0.83 REN (0.75) REN
SCHEMBL17012901 0.83 REN (0.75) REN
SCHEMBL17005441 0.83 REN (0.66) REN
SCHEMBL17005423 0.83 REN (0.66) REN
SCHEMBL17013114 0.83 REN (0.75) REN
SCHEMBL15599760 0.83 REN (0.63) REN

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-2014042263-A1 NOVEL RENIN INHIBITOR 田辺三菱製薬株式会社 (JP) 2014-03-20 — — WO disclosed
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