SCHEMBL4484176

SCHEMBL4484176

COc1cc(C(=O)Nc2n[nH]c3cc(-c4cccc(C(C)=O)c4)ccc23)cc(OC)c1OC

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 12/20 0.60
FGFR2 P21802 4/20 0.56
FGFR3 P22607 4/20 0.56
FGFR1 P11362 3/20 0.56
ABCB1 P08183 1/20 0.56
FGFR4 P22455 2/20 0.55
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
AAK1 Q2M2I8 1/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51

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
SCHEMBL4499659 0.91 HDAC6 (0.65) HDAC6FGFR2FGFR3FGFR1
SCHEMBL4504067 0.90 AAK1 (0.62) HDAC6FGFR2FGFR3FGFR1ABCB1
SCHEMBL4503216 0.89 HDAC6 (0.61) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4489688 0.88 HDAC6 (0.61) HDAC6FGFR2FGFR3FGFR1ABCB1
SCHEMBL4559843 0.88 HDAC6 (0.68) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4498565 0.86 HDAC6 (0.59) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4495749 0.86 HDAC6 (0.57) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4479787 0.85 FGFR1 (0.73) HDAC6FGFR2FGFR3FGFR1AAK1
SCHEMBL4504597 0.85 HDAC6 (0.57) HDAC6FGFR2FGFR3FGFR1FGFR4
SCHEMBL4491988 0.85 FGFR1 (0.76) HDAC6FGFR2FGFR3FGFR1FGFR4

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