SCHEMBL11210147

SCHEMBL11210147

COC1(OC)C[C@@H](C(=O)O)N(C(=O)[C@H](C)CSC(C)=O)C1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 5/20 0.50
KMT2A Q03164 1/20 0.36
REN P00797 1/20 0.35

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
SCHEMBL11214777 1.00 ACE (0.50) ACEKMT2AREN
SCHEMBL11221148 0.90 ACE (0.39) ACEREN
SCHEMBL11221151 0.90 ACE (0.39) ACEREN
SCHEMBL11214998 0.89 ACE (0.42) ACE
SCHEMBL11216175 0.89 ACE (0.47) ACEKMT2A
SCHEMBL11216172 0.89 ACE (0.47) ACEKMT2A
SCHEMBL11212958 0.88 ACE (0.38) ACE
SCHEMBL11219660 0.88 ACE (0.48) ACEREN
SCHEMBL11208390 0.85 ACE (0.36) ACE
SCHEMBL11211617 0.85 ACE (0.36) ACE

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
US-4330548-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-05-18 US disclosed
US-4311697-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-01-19 US disclosed
US-4296113-A FOR TREATING HYPERTENSION BY INHIBITING ANGIOTENSIN CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1981-10-20 US disclosed