SCHEMBL7280686

SCHEMBL7280686

CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CC(=O)N(CC(C)(C)O)CC1(O)CCCCC1)Cc1cscn1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.57

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
SCHEMBL7286744 0.91 REN (0.60) REN
SCHEMBL7289854 0.91 REN (0.60) REN
SCHEMBL7277111 0.91 REN (0.60) REN
SCHEMBL7287632 0.90 REN (0.60) REN
SCHEMBL7286690 0.90 REN (0.60) REN
SCHEMBL7278096 0.89 REN (0.67) REN
SCHEMBL7280853 0.88 REN (0.67) REN
SCHEMBL7288675 0.84 REN (0.55) REN
SCHEMBL7287494 0.82 REN (0.62) REN
SCHEMBL7280012 0.82 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
WO-1994007845-A1 N-(HYDROXYETHYL)BUTANEDIAMIDE DERIVATIVES AS RENIN INHIBITORS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-04-14 WO disclosed
EP-0589446-A1 N-(Hydroxyethyl)butanediamide derivatives as renin inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-03-30 EP disclosed