SCHEMBL13009585

SCHEMBL13009585

N#Cc1cccc(C2=C3C(=O)[IH]C(c4cccc(C#N)c4)=C3C(=O)N2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.42
PGR P06401 6/20 0.40
XDH P47989 1/20 0.38
CLK4 Q9HAZ1 1/20 0.37
SLK Q9H2G2 5/20 0.37
PRF1 P14222 1/20 0.37
STK10 O94804 4/20 0.36
IDO1 P14902 2/20 0.36
MAOB P27338 1/20 0.36
CREBBP Q92793 1/20 0.35
WEE1 P30291 1/20 0.35

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
SCHEMBL815228 0.84 CHEK1 (0.51) CHEK1PGRXDHCLK4SLK
SCHEMBL12509906 0.80 CHEK1 (0.51) CHEK1PGRXDHCLK4SLK
SCHEMBL12509754 0.78 CHEK1 (0.52) CHEK1PGRXDHCLK4SLK
SCHEMBL12425042 0.77 CHEK1 (0.43) CHEK1PGRXDHCLK4SLK
SCHEMBL7756554 0.76 CHEK1 (0.47) CHEK1PGRXDHCLK4SLK
SCHEMBL12577698 0.76 CHEK1 (0.47) CHEK1PGRXDHCLK4SLK
SCHEMBL12640589 0.76 CHEK1 (0.47) CHEK1PGRXDHCLK4SLK
SCHEMBL12509967 0.75 CHEK1 (0.43) CHEK1PGRXDHCLK4SLK
SCHEMBL12509969 0.74 CHEK1 (0.45) CHEK1PGRXDHCLK4SLK
SCHEMBL12425045 0.73 PTPN5 (0.48) CHEK1PGRSLKPRF1

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
EP-2256166-A1 Resin composition and process for producing resin molding Sony Corporation (JP) 2010-12-01 EP disclosed