SCHEMBL7543362

SCHEMBL7543362

CCOC(=O)C(N)C1CCc2ccccc2NC1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BRD4 O60885 1/20 0.39
DPP4 P27487 1/20 0.39
RIPK1 Q13546 4/20 0.39
PYGL P06737 2/20 0.39
PYGM P11217 2/20 0.39
MTNR1A P48039 2/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 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
SCHEMBL11118093 0.86 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1KDM4ETSHR
SCHEMBL31758112 0.80 FFAR1 (0.41) ALDH1A1DPP4SLC6A2SLC6A4SLC6A3
SCHEMBL29958724 0.78 PYGL (0.40) DPP4RIPK1PYGLPYGMMTNR1A
SCHEMBL7564705 0.78 IDO1 (0.46) ALDH1A1MAPTL3MBTL1
SCHEMBL2216388 0.75 NPC1 (0.47) ALDH1A1MAPTKDM4EBRD4RIPK1
SCHEMBL11116054 0.72 MAPT (0.43) ALDH1A1MAPTL3MBTL1KDM4ETSHR
SCHEMBL4342519 0.72 IDO1 (0.41) ALDH1A1MAPTDPP4RIPK1PYGL
SCHEMBL4655446 0.72 ACE (0.62) KDM4ERIPK1
SCHEMBL7756853 0.72 ACE (0.62) KDM4ERIPK1
SCHEMBL7760802 0.72 ACE (0.62) KDM4ERIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0119954-A2 3-Amino-1-benzazepin-2-one-1-alcanoic acids, process for their preparation, their pharmaceutical preparation as well as their therapeutic use CIBA-GEIGY AG (CH) 1984-09-26 EP disclosed
EP-0119955-A2 3-(5-Aminopentyl)-amino-1-benzazepin-2-one-1-alcanoic acids, process for their preparation, their pharmaceutical preparation as well as their therapeutic use CIBA-GEIGY AG (CH) 1984-09-26 EP disclosed
EP-0072352-A1 Benzazepin-2-ones, process for their preparation, pharmaceutical preparations containing these compounds and the compounds for therapeutical use CIBA-GEIGY AG (CH) 1983-02-16 EP disclosed