Sugi Predict

Sugi Predict / Compounds / SCHEMBL7319702

SCHEMBL7319702

SCHEMBL7319702

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N([C@@H](Cc1c[nH]cn1)C(N)=O)[C@@H](CC1CCCCC1)[C@@H](O)c1nccs1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.43
▸ PGC P20142 1/20 0.41

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
SCHEMBL7314710 0.89 REN (0.43) REN
SCHEMBL7319700 0.89 REN (0.41) RENPGC
SCHEMBL7319704 0.89 REN (0.41) RENPGC
SCHEMBL7309930 0.88 REN (0.46) RENPGC
SCHEMBL7314665 0.88 REN (0.46) RENPGC
SCHEMBL9523860 0.87 REN (0.46) RENPGC
SCHEMBL7370857 0.83 REN (0.54) RENPGC
SCHEMBL7299338 0.83 REN (0.46) RENPGC
SCHEMBL7313163 0.82 REN (0.43) RENPGC
SCHEMBL7326765 0.82 REN (0.43) RENPGC

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 3 patents. 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 claimed
EP-0231919-B1 N-HETEROCYCLIC ALCOHOL RENIN INHIBITORS E.R. Squibb & Sons, Inc. (US) 1993-01-20 — — EP disclosed
EP-0231919-A2 N-Heterocyclic alcohol renin inhibitors E.R. Squibb & Sons, Inc. (US) 1987-08-12 — — EP disclosed