SCHEMBL4484175

SCHEMBL4484175

Cc1cccc(C)c1-c1ccc2c(NC(=O)c3ccc(F)cc3F)n[nH]c2c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 9/20 0.52
GSK3B P49841 4/20 0.51
GSK3A P49840 1/20 0.51
FGFR4 P22455 4/20 0.47
CYP1A2 P05177 1/20 0.47
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR3 P22607 1/20 0.46
KDR P35968 1/20 0.46

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
SCHEMBL4500056 0.90 HDAC6 (0.55) HDAC6GSK3BGSK3AFGFR4FGFR1
SCHEMBL4498046 0.89 HDAC6 (0.57) HDAC6GSK3BGSK3AFGFR4FGFR1
SCHEMBL4503270 0.88 GSK3B (0.56) HDAC6GSK3BGSK3AFGFR4CYP1A2
SCHEMBL4483627 0.88 GSK3B (0.54) HDAC6GSK3BGSK3AFGFR4CYP1A2
SCHEMBL4489170 0.87 GSK3B (0.66) HDAC6GSK3BGSK3AFGFR4CYP1A2
SCHEMBL4493662 0.86 GSK3B (0.63) HDAC6GSK3BGSK3ACYP1A2FGFR1
SCHEMBL4496804 0.86 HDAC6 (0.52) HDAC6GSK3BGSK3AFGFR4FGFR1
SCHEMBL4480304 0.85 HDAC6 (0.59) HDAC6GSK3BGSK3AFGFR4FGFR1
SCHEMBL4499750 0.85 HDAC6 (0.64) HDAC6GSK3BGSK3AFGFR4CYP1A2
SCHEMBL4493989 0.85 HDAC6 (0.55) HDAC6GSK3BGSK3ACYP1A2FGFR1

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