SCHEMBL8235708

SCHEMBL8235708

CCc1cc(CN(C(=O)[C@H]2CNC[C@@H](C(=O)NC(CO)CC(C)C)C2)C2CC2)cc(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.55
KCNH2 Q12809 5/20 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
SCHEMBL89595 0.95 REN (0.58) RENKCNH2
SCHEMBL8235655 0.90 REN (0.54) RENKCNH2
SCHEMBL89120 0.89 REN (0.57) RENKCNH2
SCHEMBL8235397 0.89 REN (0.59) RENKCNH2
SCHEMBL90345 0.89 REN (0.57) RENKCNH2
SCHEMBL89087 0.89 REN (0.60) RENKCNH2
SCHEMBL88999 0.89 REN (0.60) RENKCNH2
SCHEMBL89673 0.89 REN (0.58) RENKCNH2
SCHEMBL8235654 0.88 REN (0.54) RENKCNH2
SCHEMBL89287 0.88 REN (0.57) 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
WO-2007077005-A1 3 , 5-SUBSTITΓUED PIPERIDINE COMPOUNDS AS RENIN INHIBITORS NOVARTIS AG (CH) 2007-07-12 WO disclosed