SCHEMBL11141964

SCHEMBL11141964

CCN1C(=O)C(=Cc2ccc(C#N)cc2)C(=O)N(CC)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 6/20 0.48
SIRT2 Q8IXJ6 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
MAPT P10636 4/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C9 P11712 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 2/20 0.39
MAPK1 P28482 2/20 0.39
KMT2A Q03164 2/20 0.39
TNFRSF1A P19438 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL11146884 0.89 MAPT (0.51) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11153567 0.84 MAPT (0.43) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11151011 0.76 TDP1 (0.47) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11145691 0.73 TDP1 (0.43) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11146366 0.71 TNFRSF1A (0.45) MAPTALDH1A1TDP1SMN1; SMN2GAA
SCHEMBL14713490 0.70 SIRT2 (0.39) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11314234 0.70 TNFRSF1A (0.50) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL10134153 0.70 MAPT (0.40) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11148687 0.70 TNFRSF1A (0.60) EP300SIRT2SIRT1SIRT5MAPT
SCHEMBL11142094 0.70 MEN1 (0.54) EP300SIRT2SIRT1SIRT5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4389477-A Photoconductive composition sensitized by a thiobarbituric acid derivative FUJI PHOTO FILM CO., LTD. (JP) 1983-06-21 US disclosed