SCHEMBL456923

SCHEMBL456923

COCCCOc1cc(CC(C[C@@H]2NC(=O)[C@H](C(C)C)C[C@@H]2O)C(C)C)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 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
SCHEMBL456921 1.00 REN (0.45) REN
SCHEMBL456922 1.00 REN (0.45) REN
SCHEMBL1454882 0.84 REN (0.55) REN
SCHEMBL862294 0.84 REN (0.55) REN
SCHEMBL1454881 0.84 REN (0.55) REN
SCHEMBL6855685 0.81 REN (0.33) REN
SCHEMBL856948 0.78 REN (0.45) REN
SCHEMBL8268412 0.76 REN (0.43) REN
SCHEMBL8268391 0.75 REN (0.43) REN
SCHEMBL2738428 0.74 REN (0.48) 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
WO-2012034065-A1 ALISKIREN INTERMEDIATES AND A PROCESS FOR ANALYZING THE PURITY OF ALISKIREN TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2012-03-15 WO disclosed