SCHEMBL4487681

SCHEMBL4487681

O=C(Nc1n[nH]c2cc(-c3ccccc3F)ccc12)c1ccc(F)c(F)c1

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 14/20 0.80
HDAC1 Q13547 1/20 0.61
HDAC2 Q92769 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
FGFR1 P11362 3/20 0.56
FGFR2 P21802 3/20 0.56
FGFR3 P22607 2/20 0.56
FGFR4 P22455 2/20 0.54
GSK3B P49841 1/20 0.53

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
SCHEMBL4492649 0.91 HDAC6 (0.67) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4486923 0.89 HDAC6 (0.73) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4503242 0.88 HDAC6 (0.63) HDAC6FGFR1FGFR2FGFR3FGFR4
SCHEMBL4500986 0.88 HDAC6 (0.76) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4492281 0.88 HDAC6 (0.63) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4486822 0.85 HDAC6 (0.62) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4502956 0.85 HDAC6 (0.74) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4499175 0.85 HDAC6 (0.70) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4496333 0.84 HDAC6 (0.69) HDAC6HDAC1HDAC2HDAC8FGFR1
SCHEMBL4475906 0.84 HDAC6 (0.69) HDAC6HDAC1HDAC2HDAC8FGFR1

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