SCHEMBL4491789

SCHEMBL4491789

CN(C)c1ccc(-c2ccc3c(NC(=O)c4ccc(F)c(F)c4)n[nH]c3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.62
HDAC6 Q9UBN7 13/20 0.58
ABL1 P00519 2/20 0.55
BCR P11274 2/20 0.55
FGFR1 P11362 2/20 0.55
FGFR2 P21802 2/20 0.55
FGFR3 P22607 1/20 0.54
FLT3 P36888 1/20 0.54

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
SCHEMBL4504223 0.85 GSK3B (0.62) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4489997 0.85 HDAC6 (0.61) GSK3BHDAC6FGFR1FGFR2FGFR3
SCHEMBL4488600 0.85 HDAC6 (0.61) GSK3BHDAC6FGFR1FGFR2FGFR3
SCHEMBL4497695 0.85 HDAC6 (0.65) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4479684 0.84 HDAC6 (0.65) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4491906 0.84 GSK3B (0.61) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4496882 0.83 GSK3B (0.62) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4488725 0.83 GSK3B (0.60) GSK3BHDAC6FGFR1FGFR2FGFR3
SCHEMBL4480819 0.82 GSK3B (0.61) GSK3BHDAC6ABL1BCRFGFR1
SCHEMBL4506341 0.82 HDAC6 (0.59) HDAC6FGFR1FGFR2FGFR3

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