SCHEMBL9541645

SCHEMBL9541645

NC(=O)CN1C(=O)C(NC(=O)Nc2cccc(CS)c2)CC(c2ccccc2)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.62

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
SCHEMBL8922823 0.88 CCKBR (0.78) CCKBR
SCHEMBL8920596 0.88 CCKBR (0.79) CCKBR
SCHEMBL8921040 0.88 CCKBR (0.81) CCKBR
SCHEMBL8922593 0.88 CCKBR (0.64) CCKBR
SCHEMBL9361975 0.87 CCKBR (0.81) CCKBR
SCHEMBL9541640 0.86 CCKBR (0.62) CCKBR
SCHEMBL9542911 0.86 CCKBR (0.65) CCKBR
SCHEMBL9541536 0.85 CCKBR (0.70) CCKBR
SCHEMBL9541596 0.84 CCKBR (0.71) CCKBR
SCHEMBL9541319 0.84 CCKBR (0.72) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993015059-A1 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS PFIZER INC. (US) 1993-08-05 WO disclosed