SCHEMBL8476452

SCHEMBL8476452

COCCCc1cn(C)c2ccc(CC(C[C@H](NC(=O)[C@@H](N)C(C)C)C(O)CC(C(=O)NCC3CC3)C(C)C)C(C)C)cc12

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 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
SCHEMBL4755815 1.00 REN (0.45) REN
SCHEMBL8469012 0.91 REN (0.42) REN
SCHEMBL4754622 0.91 REN (0.42) REN
SCHEMBL8468872 0.88 REN (0.43) REN
SCHEMBL4756492 0.88 REN (0.43) REN
SCHEMBL8475970 0.87 REN (0.45) REN
SCHEMBL8475985 0.83 REN (0.45) REN
SCHEMBL4757255 0.83 REN (0.45) REN
SCHEMBL8471726 0.81 REN (0.41) REN
SCHEMBL8471863 0.80 REN (0.40) 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