SCHEMBL7541608

SCHEMBL7541608

CC(C(=O)OC(C)(C)C)N1C(=O)C(N)CCc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.46
CACNA1C Q13936 2/20 0.41

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
SCHEMBL10536023 0.94 SCN9A (0.43) SCN9ACACNA1C
SCHEMBL8837676 0.83 ACE (0.43)
Hydrochloric Acid SCHEMBL7487323 0.82 ACE (0.43)
SCHEMBL10811657 0.79 MAPT (0.40)
SCHEMBL30954347 0.76 CCKBR (0.60)
SCHEMBL30044625 0.76 CCKBR (0.60)
SCHEMBL10736517 0.76 CCKBR (0.60)
SCHEMBL5698825 0.76 CCKBR (0.60)
SCHEMBL5672901 0.76 CCKBR (0.60)
SCHEMBL10814256 0.75 AADAT (0.50)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4575503-A ANGIOTENSIN CONVERTING ENZYME INHIBITOR, HYPOTENSIVE CIBA-GEIGY CORPORATION (US) 1986-03-11 US disclosed
US-4473575-A ANGIOTENSIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1984-09-25 US disclosed
US-4410520-A ANGIOTENSION CONVERTING ENZYME INGIBITOR, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
EP-0072352-A1 Benzazepin-2-ones, process for their preparation, pharmaceutical preparations containing these compounds and the compounds for therapeutical use CIBA-GEIGY AG (CH) 1983-02-16 EP disclosed