SCHEMBL11077818

SCHEMBL11077818

CCOC(=O)CC[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C(=O)OCC

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.55

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
SCHEMBL11070147 0.92 ACE (0.66) ACE
SCHEMBL11067556 0.90 ACE (0.47) ACE
SCHEMBL10909660 0.87 ACE (0.72) ACE
SCHEMBL10910491 0.87 ACE (0.72) ACE
SCHEMBL10815130 0.86 ACE (0.55) ACE
SCHEMBL10813979 0.85 ACE (0.57) ACE
SCHEMBL10909302 0.85 ACE (0.52) ACE
SCHEMBL11171055 0.84 ACE (0.53) ACE
SCHEMBL10909300 0.84 ACE (0.53) ACE
SCHEMBL10908705 0.84 ACE (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4479963-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1984-10-30 US disclosed
EP-0105919-A1 1-CARBOXYALKANOYLPERHYDROINDOLE-2-CARBOXYLIC ACIDS AND DERIVATIVES. CIBA GEIGY AG (CH) 1984-04-25 EP disclosed
WO-1983003828-A1 1-CARBOXYALKANOYLPERHYDROINDOLE-2-CARBOXYLIC ACIDS AND DERIVATIVES CIBA-GEIGY AG (CH) 1983-11-10 WO disclosed
US-4374847-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1983-02-22 US disclosed