SCHEMBL4483610

SCHEMBL4483610

O=C(Nc1n[nH]c2cc(-c3cc(F)ccc3F)ccc12)C(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.64
HDAC6 Q9UBN7 6/20 0.53
HDAC1 Q13547 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
GSK3A P49840 2/20 0.48
FGFR4 P22455 2/20 0.47
FGFR1 P11362 2/20 0.46
FGFR2 P21802 2/20 0.46
FGFR3 P22607 2/20 0.46
CYP1A2 P05177 1/20 0.44
DYRK1A Q13627 1/20 0.44

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
SCHEMBL4483786 0.91 HDAC6 (0.64) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4480354 0.88 GSK3B (0.60) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4492160 0.88 HDAC6 (0.66) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4502410 0.87 GSK3B (0.58) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4482990 0.86 GSK3B (0.65) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4481457 0.85 GSK3B (0.69) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4491683 0.84 HDAC6 (0.70) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4480882 0.84 GSK3B (0.59) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4502518 0.84 GSK3B (0.65) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4497956 0.82 GSK3B (0.52) GSK3BHDAC6HDAC1HDAC2HDAC8

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