SCHEMBL7316478

SCHEMBL7316478

CC(CC(C)C(=O)N1c2ccc(Cl)cc2CC1C(=O)O)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.53

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
SCHEMBL11083051 0.90 ACE (0.45) ACE
SCHEMBL10920023 0.87 ACE (0.70) ACE
SCHEMBL7323422 0.87 ACE (0.54) ACE
SCHEMBL11075229 0.84 ACE (0.51) ACE
SCHEMBL7316482 0.83 ACE (0.37) ACE
SCHEMBL11196761 0.83 ACE (0.75) ACE
SCHEMBL828672 0.83 ACE (0.75) ACE
SCHEMBL5563136 0.83 ACE (0.48) ACE
SCHEMBL5563133 0.83 ACE (0.48) ACE
Water SCHEMBL11075523 0.82 ACE (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050850-A1 1-Carboxyalkanoylindolin-2-carboxylic acids and derivatives thereof, processes for their preparation, and pharmaceutical compositions containing these compounds CIBA-GEIGY AG (CH) 1982-05-05 EP disclosed