SCHEMBL4757259

SCHEMBL4757259

COCCCC(c1ccc2cc[nH]c2c1)[C@@H](C[C@H](NC(=O)[C@@H](N)C(C)C)[C@@H](O)C[C@H](C(=O)NCC1CC1)C(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 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
SCHEMBL4757263 0.90 REN (0.33) REN
SCHEMBL4754056 0.90 REN (0.42) REN
SCHEMBL4756439 0.89 REN (0.33) REN
SCHEMBL4755820 0.79 REN (0.35) REN
SCHEMBL4757256 0.77 REN (0.31) REN
SCHEMBL4756494 0.77 REN (0.34) REN
SCHEMBL3466069 0.76 PDE2A (0.32) REN
SCHEMBL3464389 0.76 PDE2A (0.32) REN
SCHEMBL4756432 0.75
SCHEMBL4754697 0.75 REN (0.31) 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
EP-1911762-A1 Amino alcohols and their use as renin inhibitors Speedel Experimenta AG (CH) 2008-04-16 EP disclosed