SCHEMBL4494342

SCHEMBL4494342

CSc1ccccc1-c1ccc2c(NC(=O)c3ccc(Cl)cc3Cl)n[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 11/20 0.55
GSK3B P49841 3/20 0.53
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
PAK1 Q13153 1/20 0.47
FGFR1 P11362 1/20 0.45
FGFR2 P21802 1/20 0.45
FGFR3 P22607 1/20 0.45
FGFR4 P22455 3/20 0.45

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
SCHEMBL4488985 0.86 HDAC6 (0.59) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL4490432 0.85 HDAC6 (0.60) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4493482 0.85 HDAC6 (0.66) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4486337 0.83 HDAC6 (0.60) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4503189 0.83 HDAC6 (0.55) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4497949 0.83 GSK3B (0.55) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4489736 0.82 HDAC6 (0.63) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4484043 0.81 HDAC6 (0.58) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4491338 0.81 HDAC6 (0.55) HDAC6GSK3BHDAC1HDAC2HDAC8
SCHEMBL4489000 0.81 HDAC6 (0.57) 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