SCHEMBL4082950

SCHEMBL4082950

CC(C)(NC(=O)c1cc2[nH]nc(NC(=O)c3cccc(F)c3)c2o1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.44
CDC7 O00311 2/20 0.43
DYRK3 O43781 2/20 0.43
MAP4K4 O95819 2/20 0.43
RPS6KB1 P23443 2/20 0.43
CLK2 P49760 2/20 0.43
CSNK2A1 P68400 2/20 0.43
DYRK1A Q13627 2/20 0.43
MKNK2 Q9HBH9 2/20 0.43
PDPK1 O15530 2/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
DCLK1 O15075 1/20 0.43
MAPK13 O15264 1/20 0.43
DAPK3 O43293 1/20 0.43
JAK2 O60674 1/20 0.43
RPS6KA5 O75582 1/20 0.43
PRKD3 O94806 1/20 0.43
PAK4 O96013 1/20 0.43
CHEK2 O96017 1/20 0.43

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
SCHEMBL4088217 0.91 AURKA (0.51) AURKAJAK2FGFR1FGFR3MAPK1
SCHEMBL4088609 0.91 AURKA (0.49) AURKACDC7MAP4K4CLK2DYRK1A
SCHEMBL4088617 0.87 CDK7 (0.46) AURKACDC7MAP4K4CLK2DYRK1A
SCHEMBL4092679 0.85 AURKA (0.49) AURKACDC7CLK2DYRK1ADAPK3
SCHEMBL4083477 0.85 AURKA (0.42) AURKAPAK4MAPK1TP53SMN1; SMN2
SCHEMBL4088455 0.84 AURKA (0.47) AURKAFGFR1FGFR3MAPK1CDK7
SCHEMBL4078750 0.84 AURKA (0.45) AURKAFGFR1FGFR3MAPK1CDK7
SCHEMBL4088257 0.84 AURKA (0.47) AURKACDC7DYRK3MAP4K4RPS6KB1
SCHEMBL4084047 0.84 AURKA (0.42) AURKAFGFR1FGFR3CDK7CCNA2
SCHEMBL4091567 0.83 AURKA (0.48) AURKAFGFR1FGFR3FLT3NPC1

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-2058315-A1 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors Nerviano Medical Sciences S.r.l. (IT) 2009-05-13 EP disclosed