SCHEMBL4494405

SCHEMBL4494405

Cc1cccc(-c2ccc3c(NC(=O)NCCc4ccccc4)n[nH]c3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.55
GSK3A P49840 1/20 0.51
FGFR1 P11362 3/20 0.50
FGFR2 P21802 2/20 0.50
FGFR3 P22607 2/20 0.50
HDAC6 Q9UBN7 2/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
AAK1 Q2M2I8 3/20 0.48
GAK O14976 1/20 0.47
STK16 O75716 1/20 0.47
CDKL2 Q92772 1/20 0.47
BMP2K Q9NSY1 1/20 0.47
MAPK1 P28482 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FGFR4 P22455 1/20 0.46
CYP1A2 P05177 1/20 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
SCHEMBL4480187 0.88 GSK3B (0.59) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4485340 0.87 AAK1 (0.62) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4495365 0.87 HDAC1 (0.61) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4488734 0.87 GSK3B (0.53) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4494624 0.87 GSK3B (0.53) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4490359 0.87 MAPK1 (0.55) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4492570 0.86 GSK3B (0.59) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4497732 0.86 GSK3B (0.69) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4498152 0.86 GSK3B (0.52) GSK3BGSK3AFGFR1FGFR2FGFR3
SCHEMBL4502574 0.86 GSK3B (0.57) GSK3BFGFR1FGFR2FGFR3HDAC6

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