SCHEMBL4489254

SCHEMBL4489254

COc1ccc(-c2ccc3c(NC(=O)C(C)C)n[nH]c3c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.67
HDAC1 Q13547 7/20 0.64
HDAC2 Q92769 7/20 0.64
HDAC8 Q9BY41 7/20 0.64
FGFR4 P22455 1/20 0.58
AAK1 Q2M2I8 1/20 0.56
GSK3B P49841 7/20 0.53

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
SCHEMBL4503079 0.90 HDAC6 (0.69) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4496051 0.87 HDAC6 (0.56) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4488789 0.87 HDAC6 (0.56) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4494393 0.86 GSK3B (0.68) HDAC6HDAC1HDAC2HDAC8AAK1
SCHEMBL4477055 0.86 GSK3B (0.65) HDAC6AAK1GSK3B
SCHEMBL4494131 0.86 HDAC6 (0.71) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4494209 0.86 GSK3B (0.72) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4503677 0.86 HDAC6 (0.65) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4505011 0.86 HDAC6 (0.59) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4480598 0.85 HDAC6 (0.61) HDAC6HDAC1HDAC2HDAC8FGFR4

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