SCHEMBL4479684

SCHEMBL4479684

CN(C)c1ccc(-c2ccc3c(NC(=O)c4cccc(Cl)c4)n[nH]c3c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.65
GSK3B P49841 1/20 0.61
FGFR2 P21802 3/20 0.59
FGFR3 P22607 3/20 0.59
FGFR1 P11362 2/20 0.59
FLT3 P36888 1/20 0.53
FGFR4 P22455 1/20 0.52
ABL1 P00519 1/20 0.52
BCR P11274 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC8 Q9BY41 1/20 0.52

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
SCHEMBL4497695 0.91 HDAC6 (0.65) HDAC6GSK3BFGFR2FGFR3FGFR1
SCHEMBL4487385 0.88 HDAC6 (0.70) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4492891 0.85 HDAC6 (0.70) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4495251 0.85 HDAC6 (0.70) HDAC6GSK3BFGFR2FGFR3FGFR1
SCHEMBL4490174 0.85 HDAC6 (0.70) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4477038 0.85 GSK3B (0.58) HDAC6GSK3BFGFR2FGFR3FGFR1
SCHEMBL4491789 0.84 GSK3B (0.62) HDAC6GSK3BFGFR2FGFR3FGFR1
SCHEMBL4487142 0.84 HDAC6 (0.69) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL1461326 0.83 HDAC6 (0.66) HDAC6GSK3BFGFR2FGFR3FGFR1
SCHEMBL4487092 0.83 HDAC6 (0.64) HDAC6GSK3BFGFR2FGFR3FGFR1

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