SCHEMBL10282956

SCHEMBL10282956

CCCCCN1C(=O)C(C)(C)Oc2ccc(N(C(=O)[C@H]3CNC[C@@H](C(=O)N[C@@H](COCC)CC(C)C)C3)C3CC3)cc21

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.70
KCNH2 Q12809 5/20 0.52

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
SCHEMBL90698 0.95 REN (0.70) RENKCNH2
SCHEMBL90731 0.94 REN (0.77) RENKCNH2
SCHEMBL89643 0.94 REN (0.71) RENKCNH2
SCHEMBL8235281 0.94 REN (0.71) RENKCNH2
SCHEMBL90339 0.94 REN (0.71) RENKCNH2
SCHEMBL89911 0.94 REN (0.80) RENKCNH2
SCHEMBL89781 0.94 REN (0.80) RENKCNH2
SCHEMBL90125 0.94 REN (0.69) RENKCNH2
SCHEMBL90587 0.94 REN (0.68) RENKCNH2
SCHEMBL89229 0.94 REN (0.70) RENKCNH2

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-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed