SCHEMBL4487092

SCHEMBL4487092

Cc1cccc(C)c1-c1ccc2c(NC(=O)c3cccc(Cl)c3)n[nH]c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 12/20 0.64
FGFR2 P21802 3/20 0.55
FGFR3 P22607 3/20 0.55
FGFR1 P11362 2/20 0.55
JAK2 O60674 1/20 0.52
JAK1 P23458 1/20 0.52
FGFR4 P22455 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
GSK3B P49841 2/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
CDC7 O00311 1/20 0.50
DAPK3 O43293 1/20 0.50
PAK4 O96013 1/20 0.50
CDK2 P24941 1/20 0.50
FLT3 P36888 1/20 0.50
CSNK1A1 P48729 1/20 0.50
CLK2 P49760 1/20 0.50

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
SCHEMBL4490781 0.94 HDAC6 (0.67) HDAC6FGFR2FGFR3FGFR1GSK3B
SCHEMBL4493689 0.90 HDAC6 (0.62) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4480768 0.89 FGFR1 (0.69) HDAC6FGFR2FGFR3FGFR1GSK3B
SCHEMBL4492891 0.87 HDAC6 (0.70) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4495251 0.87 HDAC6 (0.70) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4480304 0.87 HDAC6 (0.59) HDAC6FGFR2FGFR3FGFR1JAK2
SCHEMBL4493867 0.86 HDAC6 (0.60) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4484043 0.86 HDAC6 (0.58) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4488594 0.86 HDAC6 (0.60) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL1461326 0.85 HDAC6 (0.66) HDAC6FGFR2FGFR3FGFR1JAK2

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-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US claimed