SCHEMBL4495002

SCHEMBL4495002

O=C(Nc1n[nH]c2cc(-c3cc(F)ccc3F)ccc12)c1ccc(F)cc1F

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.69
HDAC6 Q9UBN7 9/20 0.57
FGFR4 P22455 3/20 0.54
HDAC1 Q13547 2/20 0.49
HDAC2 Q92769 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
GSK3A P49840 1/20 0.49
FGFR1 P11362 2/20 0.49
FGFR2 P21802 2/20 0.49
FGFR3 P22607 2/20 0.49
CYP1A2 P05177 1/20 0.47

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
SCHEMBL4482434 0.91 HDAC6 (0.69) GSK3BHDAC6FGFR4HDAC1HDAC2
SCHEMBL4485554 0.91 GSK3B (0.66) GSK3BHDAC6FGFR4HDAC1HDAC2
SCHEMBL4492586 0.90 GSK3B (0.58) GSK3BHDAC6FGFR4GSK3AFGFR1
SCHEMBL4493662 0.90 GSK3B (0.63) GSK3BHDAC6GSK3AFGFR1FGFR2
SCHEMBL4495292 0.89 GSK3B (0.63) GSK3BHDAC6FGFR4HDAC1HDAC2
SCHEMBL4496111 0.88 GSK3B (0.65) GSK3BHDAC6FGFR4HDAC1HDAC2
SCHEMBL4491046 0.88 HDAC6 (0.75) GSK3BHDAC6FGFR4HDAC1HDAC2
SCHEMBL4491058 0.87 HDAC6 (0.58) GSK3BHDAC6GSK3AFGFR1FGFR2
SCHEMBL4489170 0.87 GSK3B (0.66) GSK3BHDAC6FGFR4GSK3AFGFR1
SCHEMBL4483422 0.87 HDAC6 (0.62) GSK3BHDAC6FGFR4HDAC1HDAC2

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