SCHEMBL4494870

SCHEMBL4494870

COc1cc(C(=O)Nc2n[nH]c3cc(-c4cc(C)cc(C)c4)ccc23)cc(OC)c1OC

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.69
FGFR4 P22455 2/20 0.55
FGFR2 P21802 3/20 0.52
FGFR3 P22607 3/20 0.52
FGFR1 P11362 3/20 0.52
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
KDR P35968 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
SCHEMBL4503216 0.92 HDAC6 (0.61) HDAC6FGFR4FGFR2FGFR3FGFR1
SCHEMBL4475795 0.90 HDAC6 (0.62) HDAC6FGFR4FGFR2FGFR3FGFR1
SCHEMBL4499659 0.88 HDAC6 (0.65) HDAC6FGFR2FGFR3FGFR1KDR
SCHEMBL4494412 0.87 HDAC6 (0.67) HDAC6FGFR2FGFR3FGFR1KDR
SCHEMBL4494426 0.87 HDAC6 (0.61) HDAC6FGFR2FGFR3FGFR1
SCHEMBL4499936 0.86 HDAC6 (0.58) HDAC6FGFR4FGFR2FGFR3FGFR1
SCHEMBL4504597 0.86 HDAC6 (0.57) HDAC6FGFR4FGFR2FGFR3FGFR1
SCHEMBL4504202 0.86 GSK3B (0.60) HDAC6FGFR2FGFR3FGFR1
SCHEMBL4500999 0.86 HDAC6 (0.60) HDAC6FGFR2FGFR3FGFR1KDR
SCHEMBL4489688 0.85 HDAC6 (0.61) HDAC6FGFR4FGFR2FGFR3FGFR1

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