SCHEMBL4757256

SCHEMBL4757256

COCCCC(c1ccc2c(C)c[nH]c2c1)[C@@H](C[C@H](NC(=O)C(N)C(C)C)[C@@H](O)C[C@H](C(=O)O)C(C)C)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.31
CTSC P53634 1/20 0.30

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
SCHEMBL4754095 0.89 REN (0.30) REN
SCHEMBL4539766 0.88 REN (0.35) REN
SCHEMBL4754697 0.88 REN (0.31) REN
SCHEMBL4755841 0.78
SCHEMBL4757259 0.77 REN (0.36) REN
SCHEMBL4539815 0.74 REN (0.34) REN
SCHEMBL4582672 0.74 ATM (0.33)
SCHEMBL3465271 0.72
SCHEMBL4534907 0.71
SCHEMBL4536674 0.70 REN (0.33) 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