SCHEMBL4496084

SCHEMBL4496084

O=C(Nc1n[nH]c2cc(-c3ccc(F)cc3)ccc12)c1cc(F)c(F)c(F)c1F

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.60
FGFR1 P11362 1/20 0.53
FGFR2 P21802 1/20 0.53
FGFR3 P22607 1/20 0.53
HDAC6 Q9UBN7 10/20 0.53
CYP1A2 P05177 1/20 0.51
GSK3A P49840 3/20 0.50
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
PIK3CD O00329 1/20 0.48
PIM1 P11309 1/20 0.48
CDK2 P24941 1/20 0.48
AAK1 Q2M2I8 1/20 0.48

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
SCHEMBL4500881 0.92 HDAC6 (0.62) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4494493 0.91 GSK3B (0.57) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4503174 0.91 HDAC6 (0.55) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4489909 0.89 HDAC6 (0.54) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4496111 0.89 GSK3B (0.65) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4491906 0.88 GSK3B (0.61) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4502157 0.88 HDAC6 (0.51) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4504366 0.88 GSK3B (0.59) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4498066 0.88 HDAC6 (0.58) GSK3BFGFR1FGFR2FGFR3HDAC6
SCHEMBL4493310 0.88 HDAC6 (0.64) GSK3BFGFR1FGFR2FGFR3HDAC6

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