SCHEMBL4492082

SCHEMBL4492082

CC(=O)Nc1cccc(-c2ccc3c(NC(=O)NCCCN)n[nH]c3c2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 13/20 0.63
GSK3B P49841 2/20 0.48
GAK O14976 7/20 0.47
STK16 O75716 7/20 0.47
BMP2K Q9NSY1 7/20 0.47
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
RIOK3 O14730 1/20 0.47
PIP5K1C O60331 1/20 0.47
CDKL2 Q92772 1/20 0.47
RIOK1 Q9BRS2 1/20 0.47
MYLK2 Q9H1R3 1/20 0.47
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
FGFR3 P22607 1/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC8 Q9BY41 3/20 0.46

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
SCHEMBL4491352 0.94 AAK1 (0.66) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4494923 0.91 AAK1 (0.64) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4484161 0.91 AAK1 (0.64) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4488792 0.90 AAK1 (0.68) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4479634 0.89 AAK1 (0.67) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4483440 0.88 AAK1 (0.60) AAK1GSK3BMKNK1MKNK2FGFR2
SCHEMBL4505096 0.87 GSK3B (0.51) AAK1GSK3BFGFR2FGFR3HDAC1
SCHEMBL4485340 0.86 AAK1 (0.62) AAK1GSK3BGAKSTK16BMP2K
SCHEMBL4492939 0.84 GSK3B (0.60) AAK1GSK3BHDAC1HDAC2HDAC8
SCHEMBL4503182 0.83 AAK1 (0.55) AAK1GSK3BGAKSTK16BMP2K

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