SCHEMBL4495104

SCHEMBL4495104

COc1cccc(-c2ccc3c(NC(=O)COCc4ccccc4)n[nH]c3c2)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 9/20 0.67
HDAC2 Q92769 9/20 0.67
HDAC8 Q9BY41 9/20 0.67
GSK3B P49841 3/20 0.62
HDAC6 Q9UBN7 2/20 0.61
FGFR4 P22455 3/20 0.60
FGFR1 P11362 3/20 0.58
FGFR2 P21802 2/20 0.58
FGFR3 P22607 2/20 0.58

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
SCHEMBL4499919 0.91 FGFR1 (0.72) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4493425 0.90 GSK3B (0.68) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4492088 0.89 HDAC1 (0.71) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4492931 0.88 GSK3B (0.61) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4484694 0.88 HDAC6 (0.63) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4481114 0.87 GSK3B (0.58) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4498895 0.87 GSK3B (0.58) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4501685 0.87 HDAC1 (0.76) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4487820 0.86 GSK3B (0.59) HDAC1HDAC2HDAC8GSK3BHDAC6
SCHEMBL4486646 0.86 GSK3B (0.60) HDAC1HDAC2HDAC8GSK3BHDAC6

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