SCHEMBL4482949

SCHEMBL4482949

CCOc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.74
HDAC2 Q92769 2/20 0.74
HDAC8 Q9BY41 2/20 0.74
FGFR1 P11362 1/20 0.72
FGFR2 P21802 1/20 0.72
FGFR3 P22607 1/20 0.72
HDAC6 Q9UBN7 1/20 0.69
GSK3A P49840 4/20 0.69
GSK3B P49841 4/20 0.69
AAK1 Q2M2I8 13/20 0.69
GAK O14976 4/20 0.64
STK16 O75716 4/20 0.64
BMP2K Q9NSY1 4/20 0.64
PIK3CD O00329 1/20 0.63
PIM1 P11309 1/20 0.63
CDK2 P24941 1/20 0.63
RIOK3 O14730 1/20 0.62
PIP5K1C O60331 1/20 0.62
CDKL2 Q92772 1/20 0.62
RIOK1 Q9BRS2 1/20 0.62

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
SCHEMBL4502345 0.96 FGFR1 (0.69) HDAC1HDAC2HDAC8FGFR1FGFR2
SCHEMBL4504749 0.96 FGFR1 (0.69) HDAC1HDAC2HDAC8FGFR1FGFR2
SCHEMBL4490399 0.89 HDAC1 (0.92) HDAC1HDAC2HDAC8HDAC6GSK3A
SCHEMBL4491665 0.85 HDAC1 (0.67) HDAC1HDAC2HDAC8FGFR1FGFR2
SCHEMBL4483420 0.84 HDAC1 (0.74) HDAC1HDAC2HDAC8FGFR1FGFR2
SCHEMBL4493792 0.84 FGFR1 (0.73) HDAC1HDAC2HDAC8FGFR1FGFR2
SCHEMBL4485572 0.84 HDAC1 (0.85) HDAC1HDAC2HDAC8HDAC6GSK3A
SCHEMBL4481656 0.84 HDAC1 (0.85) HDAC1HDAC2HDAC8HDAC6GSK3A
SCHEMBL12293068 0.84 AAK1 (0.73) HDAC1HDAC2HDAC8GSK3AGSK3B
SCHEMBL4493075 0.84 HDAC1 (0.70) HDAC1HDAC2HDAC8FGFR1FGFR2

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