SCHEMBL7281076

SCHEMBL7281076

CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)N(C(=O)[C@@H](CC(N)=O)CC1CC1)[C@H](CO)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.43

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
SCHEMBL7288722 1.00 REN (0.43) REN
SCHEMBL7278739 0.85 PSEN1 (0.37) REN
SCHEMBL7280239 0.79 REN (0.39) REN
SCHEMBL7288831 0.79 REN (0.39) REN
SCHEMBL7288374 0.78 REN (0.48) REN
SCHEMBL7279096 0.74 CCR1 (0.38) REN
SCHEMBL9388320 0.74 REN (0.48) REN
SCHEMBL7278947 0.73 REN (0.37) REN
SCHEMBL7287034 0.72 REN (0.37) REN
SCHEMBL7280042 0.69 REN (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0589446-B1 N-(Hydroxyethyl)butanediamide derivatives as renin inhibitors BOEHRINGER INGELHEIM CA LTD (CA) 1997-09-03 — — EP claimed
WO-1994007845-A1 N-(HYDROXYETHYL)BUTANEDIAMIDE DERIVATIVES AS RENIN INHIBITORS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-04-14 — — WO claimed
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