SCHEMBL4491565

SCHEMBL4491565

Cc1ccc(C)c(-c2ccc3c(NC(=O)c4cc(F)c(F)c(F)c4F)n[nH]c3c2)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.49
FGFR4 P22455 5/20 0.46
GSK3B P49841 4/20 0.45
FGFR1 P11362 3/20 0.44
FGFR2 P21802 3/20 0.44
FGFR3 P22607 2/20 0.44
KDR P35968 2/20 0.43
CYP1A2 P05177 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 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
SCHEMBL4498378 0.89 HDAC6 (0.57) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4494493 0.89 GSK3B (0.57) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4475921 0.88 HDAC6 (0.53) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4482482 0.87 HDAC6 (0.57) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4480249 0.86 GSK3B (0.52) HDAC6FGFR4GSK3BKDRCYP1A2
SCHEMBL4501584 0.86 FGFR4 (0.54) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4483719 0.85 HDAC6 (0.57) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4483704 0.85 HDAC6 (0.50) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4496804 0.84 HDAC6 (0.52) HDAC6FGFR4GSK3BFGFR1FGFR2
SCHEMBL4481624 0.84 HDAC6 (0.56) HDAC6FGFR4GSK3BFGFR1FGFR2

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