SCHEMBL13985103

SCHEMBL13985103

Cc1nc2ccccn2c1-c1cnc(Nc2ccc(C(=O)NO)cc2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 4/20 0.51
PRKD3 O94806 1/20 0.51
MAP4K4 O95819 1/20 0.51
PIM1 P11309 1/20 0.51
RPS6KB1 P23443 1/20 0.51
FLT4 P35916 1/20 0.51
FLT3 P36888 1/20 0.51
MAPK8 P45983 1/20 0.51
MAPK9 P45984 1/20 0.51
CSNK1D P48730 1/20 0.51
GSK3A P49840 1/20 0.51
GSK3B P49841 1/20 0.51
CSNK2A1 P68400 1/20 0.51
DYRK1A Q13627 1/20 0.51
TAOK1 Q7L7X3 1/20 0.51
PIM3 Q86V86 1/20 0.51
PRKD2 Q9BZL6 1/20 0.51
HIPK2 Q9H2X6 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
IRAK4 Q9NWZ3 1/20 0.51

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
SCHEMBL12790549 0.92 CDK2 (0.48) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL13985098 0.90 GAA (0.51) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL12790556 0.86 HDAC1 (0.56) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL13984942 0.86 HDAC6 (0.44) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL13984894 0.84 CDK2 (0.42) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL13985101 0.84 PRKD3 (0.53) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL4201089 0.83 PRKD3 (0.52) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL3688533 0.82 CSNK2A1 (0.76) CDK2PRKD3MAP4K4PIM1RPS6KB1
SCHEMBL13984939 0.82 PKM (0.48) FLT3IRAK4ALDH1A1MAPTSMN1; SMN2
SCHEMBL12790555 0.81 HDAC1 (0.40) CDK2PRKD3MAP4K4PIM1RPS6KB1

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
WO-2009002534-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2008-12-31 WO disclosed