SCHEMBL4488355

SCHEMBL4488355

O=C(Nc1n[nH]c2cc(-c3ccc(F)cc3F)ccc12)c1ccccc1F

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.63
GSK3B P49841 3/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
FGFR4 P22455 6/20 0.53
GSK3A P49840 1/20 0.50
FGFR1 P11362 1/20 0.50
FGFR2 P21802 1/20 0.50
FGFR3 P22607 1/20 0.50
KDR P35968 1/20 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
SCHEMBL4485554 0.92 GSK3B (0.66) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4482434 0.92 HDAC6 (0.69) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4502956 0.91 HDAC6 (0.74) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4480749 0.89 HDAC6 (0.62) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4488620 0.88 HDAC6 (0.61) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4488994 0.88 HDAC6 (0.70) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4488592 0.87 GSK3B (0.66) HDAC6GSK3BFGFR4GSK3AFGFR1
SCHEMBL4489909 0.86 HDAC6 (0.54) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4494888 0.86 HDAC6 (0.72) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4485588 0.85 HDAC6 (0.63) HDAC6GSK3BHDAC1HDAC2HDAC8

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