SCHEMBL8554660

SCHEMBL8554660

CC1=NC(N)C(=O)N(CC(=O)C(C)(C)C)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKAR P32238 3/20 0.47
CCKBR P32239 3/20 0.43

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
SCHEMBL9573407 0.85 GABRP (0.59) CCKARCCKBR
SCHEMBL7551420 0.83 CCKAR (0.42) CCKARCCKBR
SCHEMBL7551414 0.83 CCKAR (0.42) CCKARCCKBR
SCHEMBL8546357 0.81 CCKBR (0.61) CCKARCCKBR
SCHEMBL8544961 0.81 CCKBR (0.61) CCKARCCKBR
SCHEMBL4996686 0.81 CCKBR (0.61) CCKARCCKBR
SCHEMBL8550580 0.80 CCKBR (0.45) CCKARCCKBR
SCHEMBL8552734 0.79 POLB (0.44) CCKARCCKBR
SCHEMBL8544165 0.79 CCKBR (0.50) CCKARCCKBR
SCHEMBL8606324 0.79 CCKBR (0.50) CCKARCCKBR

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
EP-0672037-B1 1,4-BENZODIAZEPINE DERIVATIVES AND THEIR USE AS CCK-MODULATORS GLAXO GROUP LTD (GB) 1998-07-08 EP disclosed
US-5569654-A ADMINISTERING AS ANTAGONISTS OF GASTRIN AND CHOLECYSTOKININ GLAXO GROUP LIMITED (GB) 1996-10-29 US disclosed