SCHEMBL9205891

SCHEMBL9205891

CCOC(=O)[C@@H]1CN(c2ccccc2)C(=O)[C@@H]1NC(=O)c1ccc2ccccc2c1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 2/20 0.54
P2RY12 Q9H244 1/20 0.45
DRD4 P21917 3/20 0.41
SLC6A12 P48065 1/20 0.41
SLC6A13 Q9NSD5 1/20 0.41

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
SCHEMBL9205875 1.00 CCKBR (0.54) CCKBRP2RY12DRD4SLC6A12SLC6A13
SCHEMBL9205881 1.00 CCKBR (0.54) CCKBRP2RY12DRD4SLC6A12SLC6A13
SCHEMBL9200559 0.87 UBE2M (0.46) CCKBR
SCHEMBL9200577 0.87 UBE2M (0.46) CCKBR
SCHEMBL9200567 0.87 UBE2M (0.46) CCKBR
SCHEMBL9200647 0.86 CCKBR (0.52) CCKBRDRD4SLC6A12SLC6A13
SCHEMBL9200635 0.86 CCKBR (0.52) CCKBRDRD4SLC6A12SLC6A13
SCHEMBL9200663 0.86 CCKBR (0.52) CCKBRDRD4SLC6A12SLC6A13
SCHEMBL9206962 0.86 LMNA (0.50) CCKBRDRD4
SCHEMBL9206950 0.86 LMNA (0.50) CCKBRDRD4

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 4 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
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