SCHEMBL8620796

SCHEMBL8620796

CC(C)CCN1C(=O)C(N)C(=O)N(c2ccccc2F)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 13/20 0.61

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
SCHEMBL8547144 0.85 CCKBR (0.60) CCKBR
SCHEMBL8616780 0.82 CCKBR (0.61) CCKBR
SCHEMBL8866387 0.79 CCKBR (0.48) CCKBR
SCHEMBL8540648 0.78 CCKBR (0.63) CCKBR
SCHEMBL8897135 0.78 CCKBR (0.65) CCKBR
SCHEMBL8616738 0.78 CCKBR (0.60) CCKBR
SCHEMBL8634715 0.77 CCKBR (0.43) CCKBR
SCHEMBL8638093 0.76 CCKBR (1.00) CCKBR
SCHEMBL8556701 0.76 CCKBR (0.46) CCKBR
SCHEMBL8621037 0.75 CCKBR (0.71) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0558104-B1 1,5-Benzodiazepine derivatives and their use in medicine GLAXO WELLCOME SPA (IT) 1998-07-29 EP disclosed
EP-0623118-B1 CARBAMATE DERIVATIVES AND THEIR USE IN MEDICINE GLAXO WELLCOME SPA (IT) 1998-05-13 EP disclosed
US-5637697-A ANTAGONIST TO GASTRIN AND(OR) CHLOROCYSTOKININ GLAXO SPA (IT) 1997-06-10 US disclosed
US-5580895-A GASTROINTESTINAL OR CENTRAL NERVOUS SYSTEM DISORDERS GLAXO SPA (IT) 1996-12-03 US disclosed
US-5486514-A GASTRIN, CHOLECYSTOKININ RECEPTOR ANTAGONISTS GLAXO SPA (IT) 1996-01-23 US disclosed
EP-0558104-A1 1,5-Benzodiazepine derivatives and their use in medicine GLAXO S.p.A. (IT) 1993-09-01 EP disclosed