SCHEMBL9996504

SCHEMBL9996504

CNC[C@H](CC1CCCCC1)NC(=O)N1CCC[C@@H]([C@@](C)(OCCN(C)C(=O)O)c2cccc(Cl)c2)C1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.66

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
SCHEMBL3604830 0.90 REN (0.67) REN
SCHEMBL3600678 0.90 REN (0.67) REN
SCHEMBL9996214 0.88 REN (0.77) REN
SCHEMBL9996609 0.88 REN (0.77) REN
SCHEMBL3615246 0.88 REN (0.77) REN
SCHEMBL3619109 0.87 REN (0.68) REN
SCHEMBL9996396 0.87 REN (0.68) REN
SCHEMBL4972977 0.87 REN (0.68) REN
SCHEMBL3610183 0.87 REN (0.68) REN
SCHEMBL4972982 0.87 REN (0.68) 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-1966139-B1 ASPARTIC PROTEASE INHIBITORS VITAE PHARMACEUTICALS INC (US) 2011-12-21 EP claimed