SCHEMBL4489736

SCHEMBL4489736

COc1ccccc1C(=O)Nc1n[nH]c2cc(-c3ccccc3SC)ccc12

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 6/20 0.63
FGFR4 P22455 8/20 0.60
HDAC1 Q13547 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
TSHR P16473 1/20 0.52
FGFR1 P11362 3/20 0.51
FGFR2 P21802 3/20 0.51
FGFR3 P22607 1/20 0.51
CDC7 O00311 1/20 0.49
MAP4K4 O95819 1/20 0.49
PIM1 P11309 1/20 0.49
CDK2 P24941 1/20 0.49
GSK3B P49841 1/20 0.49
HIPK2 Q9H2X6 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49

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
SCHEMBL4489000 0.91 HDAC6 (0.57) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4490036 0.87 HDAC6 (0.66) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4486938 0.87 HDAC6 (0.64) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4487118 0.86 FGFR4 (0.67) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4486337 0.86 HDAC6 (0.60) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4504791 0.85 HDAC6 (0.66) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4503189 0.84 HDAC6 (0.55) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4495723 0.83 HDAC6 (0.75) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4506357 0.83 HDAC6 (0.64) HDAC6FGFR4HDAC1HDAC2HDAC8
SCHEMBL4502319 0.83 HDAC6 (0.67) HDAC6FGFR4HDAC1HDAC2HDAC8

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