SCHEMBL4498046

SCHEMBL4498046

Cc1ccccc1-c1ccc2c(NC(=O)c3ccc(F)cc3F)n[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.57
FGFR4 P22455 5/20 0.53
GSK3B P49841 4/20 0.52
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
GSK3A P49840 1/20 0.48
FGFR1 P11362 2/20 0.47
FGFR2 P21802 2/20 0.47
FGFR3 P22607 2/20 0.47
KDR P35968 1/20 0.47

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
SCHEMBL4486051 0.91 HDAC6 (0.63) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4482434 0.91 HDAC6 (0.69) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4480249 0.89 GSK3B (0.52) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4484175 0.89 HDAC6 (0.52) HDAC6FGFR4GSK3BGSK3AFGFR1
SCHEMBL4487357 0.88 HDAC6 (0.68) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4503189 0.87 HDAC6 (0.55) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4483627 0.87 GSK3B (0.54) HDAC6FGFR4GSK3BGSK3AFGFR1
SCHEMBL4495002 0.86 GSK3B (0.69) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4483422 0.86 HDAC6 (0.62) HDAC6FGFR4GSK3BHDAC1HDAC2
SCHEMBL4498378 0.86 HDAC6 (0.57) HDAC6FGFR4GSK3BHDAC1HDAC2

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