SCHEMBL9203334

SCHEMBL9203334

CC(C)(C)OC(=O)C1CN(c2ccccc2F)C(=O)C1NC(=O)c1cnc2ccccc2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.46
TNKS O95271 1/20 0.39
PDE5A O76074 2/20 0.39
PDE4A P27815 2/20 0.39
PDE1A P54750 2/20 0.39
PDE1B Q01064 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
PDE3B Q13370 2/20 0.39
PDE1C Q14123 2/20 0.39
PDE3A Q14432 2/20 0.39
DRD2 P14416 4/20 0.38
DRD3 P35462 4/20 0.38
HTR1A P08908 3/20 0.38
HTR2A P28223 3/20 0.38
HTR2C P28335 3/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38

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
SCHEMBL9203321 1.00 HPGDS (0.46) HPGDSTNKSPDE5APDE4APDE1A
SCHEMBL9203340 1.00 HPGDS (0.46) HPGDSTNKSPDE5APDE4APDE1A
SCHEMBL9276291 0.88 HPGDS (0.48) HPGDSTNKSPDE5APDE4APDE1A
SCHEMBL9276312 0.88 HPGDS (0.48) HPGDSTNKSPDE5APDE4APDE1A
SCHEMBL9276303 0.88 HPGDS (0.48) HPGDSTNKSPDE5APDE4APDE1A
SCHEMBL9205749 0.87 CCKBR (0.46) DRD2DRD3
SCHEMBL9205759 0.87 CCKBR (0.46) DRD2DRD3
SCHEMBL9205770 0.87 CCKBR (0.46) DRD2DRD3
SCHEMBL9200635 0.74 CCKBR (0.52)
SCHEMBL9200647 0.74 CCKBR (0.52)

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