SCHEMBL4495347

SCHEMBL4495347

O=C(Nc1n[nH]c2cc(-c3cccc(F)c3)ccc12)c1c(F)ccc(F)c1F

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.65
GSK3A P49840 2/20 0.65
HDAC6 Q9UBN7 8/20 0.54
CYP1A2 P05177 1/20 0.52
FGFR1 P11362 2/20 0.51
FGFR2 P21802 2/20 0.51
FGFR3 P22607 2/20 0.51
AAK1 Q2M2I8 2/20 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
SCHEMBL4502187 0.92 GSK3B (0.69) GSK3BGSK3AHDAC6CYP1A2FGFR1
SCHEMBL4502510 0.90 HDAC6 (0.67) GSK3BGSK3AHDAC6FGFR1FGFR2
SCHEMBL4480610 0.89 HDAC6 (0.54) GSK3BGSK3AHDAC6CYP1A2FGFR1
SCHEMBL4489306 0.89 HDAC6 (0.57) GSK3BGSK3AHDAC6CYP1A2FGFR1
SCHEMBL4484342 0.88 HDAC6 (0.53) GSK3BGSK3AHDAC6FGFR1FGFR2
SCHEMBL4496487 0.87 GSK3B (0.67) GSK3BGSK3AHDAC6CYP1A2FGFR1
SCHEMBL4488032 0.87 HDAC6 (0.50) GSK3BGSK3AHDAC6FGFR1FGFR2
SCHEMBL4492534 0.86 GSK3B (0.58) GSK3BGSK3AHDAC6CYP1A2FGFR1
SCHEMBL4490063 0.86 HDAC6 (0.60) GSK3BHDAC6CYP1A2FGFR1FGFR2
SCHEMBL4485957 0.85 HDAC6 (0.53) GSK3BGSK3AHDAC6CYP1A2FGFR1

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