SCHEMBL10101862

SCHEMBL10101862

CC(=O)Nc1cc(N)c(/N=N/c2c(C#N)cnn2-c2nc(O)nc(O)n2)c(N)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 14/20 0.40
MAPK9 P45984 9/20 0.40
PRKD3 O94806 4/20 0.38
MAP4K4 O95819 4/20 0.38
MAP4K2 Q12851 3/20 0.38
MAPK10 P53779 2/20 0.38
PKN2 Q16513 2/20 0.38
MAP4K5 Q9Y4K4 2/20 0.38
ITK Q08881 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
PRKD2 Q9BZL6 2/20 0.38
STK17A Q9UEE5 1/20 0.38
CHUK O15111 1/20 0.38
CDK2 P24941 1/20 0.38
CLK2 P49760 1/20 0.38
PASK Q96RG2 1/20 0.38
SRPK1 Q96SB4 1/20 0.38
DYRK1A Q13627 2/20 0.36
AURKB Q96GD4 2/20 0.36
GSK3B P49841 2/20 0.36

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
SCHEMBL13069060 0.78 PDE10A (0.34) CDK2ADORA2AXDHADORA1
SCHEMBL4742450 0.70 CSNK2A1 (0.38) CDK2GSK3BCSNK2A1HIPK2
SCHEMBL4742267 0.69 MEN1 (0.33)
SCHEMBL4742163 0.69 PTGS1 (0.40) PTGS1PTGS2XDH
SCHEMBL10101865 0.67 PTGS1 (0.32) PTGS1PTGS2XDH
SCHEMBL13430520 0.67 XDH (0.39) XDH
SCHEMBL58810 0.67 XDH (0.41) XDH
SCHEMBL10102099 0.67 CDK2 (0.35) CLK4CDK2PTGS1PTGS2ADORA2A
SCHEMBL10101838 0.67 CDK2 (0.35) CLK4CDK2PTGS1PTGS2ADORA2A
SCHEMBL15233455 0.66 XDH (0.39) XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed