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Sugi Predict / Compounds / SCHEMBL7313206

SCHEMBL7313206

SCHEMBL7313206

CC(C)C[C@H](N)C(=O)N(C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@@H](CC1CCCCC1)[C@@H](O)c1ncc[nH]1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.48
▸ PGC P20142 1/20 0.42

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
SCHEMBL7320908 0.90 REN (0.46) RENPGC
SCHEMBL7320920 0.90 REN (0.46) RENPGC
SCHEMBL7313212 0.88 REN (0.52) REN
SCHEMBL7320914 0.85 REN (0.47) RENPGC
SCHEMBL7321722 0.83 REN (0.43) REN
SCHEMBL7373753 0.81 REN (0.63) RENPGC
SCHEMBL7314665 0.81 REN (0.46) RENPGC
SCHEMBL7309930 0.81 REN (0.46) RENPGC
SCHEMBL7316224 0.81 REN (0.40) RENPGC
SCHEMBL7316295 0.81 REN (0.47) 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-0231919-B1 N-HETEROCYCLIC ALCOHOL RENIN INHIBITORS E.R. Squibb & Sons, Inc. (US) 1993-01-20 — — EP disclosed