SCHEMBL11269009

SCHEMBL11269009

O=C1CCN(C(=O)CCS)C(C(=O)O)C1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.49
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL11265881 0.84 ACE (0.58) ACE
SCHEMBL11261402 0.79 ACE (0.45) ACE
SCHEMBL5224593 0.78
SCHEMBL5223810 0.78
SCHEMBL15542290 0.78
SCHEMBL7377569 0.76 ACE (0.54) ACE
SCHEMBL11272976 0.75 ACE (0.49) ACE
SCHEMBL683432 0.73 ACE (0.69) ACE
SCHEMBL6789982 0.73 ACE (0.69) ACE
SCHEMBL6789984 0.73 ACE (0.69) 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 2 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-4296113-A FOR TREATING HYPERTENSION BY INHIBITING ANGIOTENSIN CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1981-10-20 US disclosed