SCHEMBL8404669

SCHEMBL8404669

CCc1ccc2c(c1)NC(=O)CCC2c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 13/20 0.51
DDB1 Q16531 12/20 0.51
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
PARP1 P09874 2/20 0.43
KIF11 P52732 2/20 0.42
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL8399014 0.83 DDB1 (0.55) CRBNDDB1SLC6A2SLC6A4SLC6A3
SCHEMBL8398580 0.80 SLC6A2 (0.43) CRBNDDB1SLC6A2SLC6A4SLC6A3
SCHEMBL3053841 0.79 DDB1 (0.65) CRBNDDB1SMN1; SMN2
SCHEMBL8402191 0.77 SLC6A2 (0.47) CRBNDDB1SLC6A2SLC6A4SLC6A3
SCHEMBL24548362 0.76 CRBN (0.63) CRBNDDB1
SCHEMBL8921539 0.75 DDB1 (0.55) CRBNDDB1
SCHEMBL8402142 0.74 THRB (0.50) CRBNDDB1SLC6A2SLC6A4SLC6A3
SCHEMBL8922488 0.72 DDB1 (0.55) CRBNDDB1LMNA
SCHEMBL26296845 0.72 CRBN (0.61) CRBNDDB1
SCHEMBL25935699 0.72 CRBN (0.65) CRBNDDB1

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-0711283-B1 TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS PFIZER (US) 1999-06-16 EP disclosed
US-5618811-A Tetrahydro-1H-benzazepinones and hexahydroazepinones as selective cholecystokinin-B receptor antagonists PFIZER INC. (US) 1997-04-08 US disclosed
EP-0711283-A1 TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS PFIZER INC. (US) 1996-05-15 EP disclosed
WO-1995003281-A1 TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS PFIZER INC. (US) 1995-02-02 WO disclosed