SCHEMBL4754640

SCHEMBL4754640

COCCCOc1cc(C[C@@H](C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)CN2CCCCC2)C(C)C)ccc1OC

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.59

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
SCHEMBL4754655 1.00 REN (0.59) REN
SCHEMBL4756787 0.94 REN (0.57) REN
SCHEMBL4756784 0.94 REN (0.57) REN
SCHEMBL3273394 0.90 REN (0.63) REN
SCHEMBL3273391 0.90 REN (0.63) REN
SCHEMBL6044461 0.90 REN (0.74) REN
SCHEMBL6044467 0.90 REN (0.74) REN
SCHEMBL4754694 0.89 REN (0.59) REN
SCHEMBL4754684 0.89 REN (0.59) REN
SCHEMBL4877996 0.88 REN (0.53) 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