SCHEMBL11019149

SCHEMBL11019149

O=C(O)CN1CCCCC(NCC(=O)C(Cc2ccccc2)NC(=O)c2ccccc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 17/20 0.57
MME P08473 1/20 0.57
ACE2 Q9BYF1 5/20 0.52

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
SCHEMBL11019134 1.00 ACE (0.57) ACEMMEACE2
SCHEMBL10813535 0.85 ACE (0.46) ACEMMEACE2
SCHEMBL11018354 0.82 ACE (0.56) ACEMME
SCHEMBL11018351 0.82 ACE (0.56) ACEMME
SCHEMBL11018346 0.82 ACE (0.56) ACEMME
SCHEMBL10795369 0.79 ACE (0.80) ACEMME
SCHEMBL10795378 0.79 ACE (0.80) ACEMME
SCHEMBL7326895 0.77 ACE (0.52) ACEMMEACE2
SCHEMBL7326888 0.77 ACE (0.52) ACEMMEACE2
SCHEMBL10808452 0.75 ACE (0.43) ACEACE2

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-0142335-A2 Lactam containing compounds E.R. Squibb & Sons, Inc. (US) 1985-05-22 EP claimed
EP-0142335-A2 Lactam containing compounds E.R. Squibb & Sons, Inc. (US) 1985-05-22 EP disclosed
US-4474778-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1984-10-02 US disclosed