SCHEMBL9205759

SCHEMBL9205759

CC(C)(C)OC(=O)C1CN(c2ccccc2F)C(=O)C1NC(=O)c1ccc2ccccc2c1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.46
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
ADRA1A P35348 1/20 0.41
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MCHR1 Q99705 1/20 0.38
KAT6A Q92794 1/20 0.37

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
SCHEMBL9205749 1.00 CCKBR (0.46) CCKBRDRD2DRD3ADRA1AGAA
SCHEMBL9205770 1.00 CCKBR (0.46) CCKBRDRD2DRD3ADRA1AGAA
SCHEMBL9203334 0.87 HPGDS (0.46) DRD2DRD3
SCHEMBL9203340 0.87 HPGDS (0.46) DRD2DRD3
SCHEMBL9203321 0.87 HPGDS (0.46) DRD2DRD3
SCHEMBL9200635 0.87 CCKBR (0.52) CCKBR
SCHEMBL9200663 0.87 CCKBR (0.52) CCKBR
SCHEMBL9200647 0.87 CCKBR (0.52) CCKBR
SCHEMBL9302071 0.86 CCKBR (0.62) CCKBRDRD2DRD3ADRA1AGAA
SCHEMBL9208975 0.86 CCKBR (0.62) CCKBRDRD2DRD3ADRA1AGAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561941-B1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS SEARLE & CO (US) 1995-01-04 EP disclosed
US-5314886-A N-substituted lactams useful as cholecystokinin antagonists G. D. SEARLE & CO. (US) 1994-05-24 US disclosed
EP-0561941-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS. SEARLE & CO (US) 1993-09-29 EP disclosed
US-5202344-A Disorders of the gastrointestinal, central nervous system and appetite regulatory systems G. D. SEARLE & CO. (US) 1993-04-13 US disclosed
WO-1992010476-A1 N-SUBSTITUTED LACTAMS USEFUL AS CHOLECYSTOKININ ANTAGONISTS G.D. SEARLE & CO. (US) 1992-06-25 WO disclosed