SCHEMBL8903288

SCHEMBL8903288

CC(C)(C)OC(=O)CN1C(=O)[C@@H](NC(=O)Nc2cccc(Cl)c2)CSc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.66

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
SCHEMBL8903002 0.91 CCKBR (0.72) CCKBR
SCHEMBL8903211 0.91 CCKBR (0.72) CCKBR
SCHEMBL8903724 0.91 CCKBR (0.71) CCKBR
SCHEMBL8904790 0.89 CCKBR (0.73) CCKBR
SCHEMBL9362960 0.81 CCKBR (0.87) CCKBR
SCHEMBL8903172 0.80 CCKBR (0.51) CCKBR
SCHEMBL8903311 0.80 CCKBR (0.51) CCKBR
SCHEMBL9435303 0.78 CCKBR (0.68) CCKBR
SCHEMBL8904366 0.78 CCKBR (0.68) CCKBR
SCHEMBL8904887 0.78 CCKBR (0.69) CCKBR

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-5618808-A Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists PFIZER, INC. (US) 1997-04-08 US disclosed
WO-1994001421-A1 BENZOTHIAZEPINE AND BENZOXAZEPINE DERIVATIVES AS CHOLECYSTOKININ RECEPTOR ANTAGONISTS PFIZER INC. (US) 1994-01-20 WO disclosed