SCHEMBL4493841

SCHEMBL4493841

COc1cc(C(=O)Nc2n[nH]c3cc(-c4ccccc4C)ccc23)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 11/20 0.67
HDAC1 Q13547 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
FGFR1 P11362 4/20 0.53
FGFR2 P21802 4/20 0.53
FGFR4 P22455 2/20 0.53
FGFR3 P22607 2/20 0.53
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
PKM P14618 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
GSK3B P49841 1/20 0.50

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
SCHEMBL4499936 0.89 HDAC6 (0.58) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4482496 0.89 HDAC6 (0.69) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4504597 0.89 HDAC6 (0.57) HDAC6FGFR1FGFR2FGFR4FGFR3
SCHEMBL4486938 0.88 HDAC6 (0.64) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4475795 0.87 HDAC6 (0.62) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4495202 0.87 HDAC6 (0.68) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4490036 0.86 HDAC6 (0.66) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4492428 0.85 HDAC6 (0.62) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4503216 0.85 HDAC6 (0.61) HDAC6FGFR1FGFR2FGFR4FGFR3
SCHEMBL4494870 0.85 HDAC6 (0.69) HDAC6HDAC1HDAC2HDAC8FGFR1

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