SCHEMBL4488932

SCHEMBL4488932

CSc1ccccc1-c1ccc2c(NC(=O)C(OC(C)=O)c3ccccc3)n[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.46
HDAC6 Q9UBN7 6/20 0.45
HDAC1 Q13547 5/20 0.43
HDAC2 Q92769 5/20 0.43
HDAC8 Q9BY41 5/20 0.43
FGFR1 P11362 2/20 0.43
FGFR2 P21802 2/20 0.43
FGFR3 P22607 2/20 0.43
GSK3A P49840 1/20 0.43
CASP3 P42574 1/20 0.40
CASP2 P42575 1/20 0.40
CASP7 P55210 1/20 0.40
CASP6 P55212 1/20 0.40
CASP8 Q14790 1/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL4480829 0.88 GSK3B (0.48) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4494521 0.88 GSK3B (0.49) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4477054 0.87 HDAC6 (0.58) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4486198 0.84 AAK1 (0.52) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4502796 0.84 FGFR1 (0.52) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4483860 0.83 GSK3B (0.46) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4493437 0.83 HDAC6 (0.54) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4503236 0.83 GSK3B (0.50) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4502553 0.83 HDAC6 (0.55) GSK3BHDAC6HDAC1HDAC2HDAC8
SCHEMBL4491583 0.83 GSK3B (0.53) 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