SCHEMBL4959536

SCHEMBL4959536

COCCCN1CCOc2ccc(C(O[C@H]3CN[C@H](CO[Si](C(C)C)(C(C)C)C(C)C)C[C@@H]3c3ccc(COC)cc3)S(=O)(=O)c3ccc(C)cc3)cc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 1/20 0.31

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
SCHEMBL1040946 0.96 REN (0.31) REN
SCHEMBL1517998 0.95 REN (0.31) REN
SCHEMBL1517810 0.94
SCHEMBL1517811 0.94
SCHEMBL2918851 0.94 REN (0.32) REN
SCHEMBL2389135 0.92
SCHEMBL2389133 0.92
SCHEMBL4961314 0.90 REN (0.32) REN
SCHEMBL2918021 0.86 REN (0.31) REN
SCHEMBL1518000 0.85

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-1897879-A2 2,4,5 substituted piperidines as renin inhibitors Speedel Experimenta AG (CH) 2008-03-12 EP disclosed