SCHEMBL4494906

SCHEMBL4494906

O=C(COCc1ccccc1)Nc1n[nH]c2cc(-c3cccs3)ccc12

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 15/20 0.60
GSK3A P49840 2/20 0.60
CDK2 P24941 1/20 0.60
FGFR4 P22455 1/20 0.58
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC8 Q9BY41 1/20 0.48
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
FGFR1 P11362 1/20 0.47
FGFR2 P21802 1/20 0.47
FGFR3 P22607 1/20 0.47
HDAC3 O15379 1/20 0.46
CYP1A2 P05177 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
SCHEMBL4493425 0.87 GSK3B (0.68) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4500115 0.85 GSK3B (0.66) GSK3BGSK3ACDK2FGFR4HDAC1
SCHEMBL4498496 0.84 GSK3B (0.67) GSK3BGSK3ACDK2HDAC1HDAC2
SCHEMBL4499197 0.83 GSK3B (0.67) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4490970 0.83 GSK3B (0.65) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4506071 0.82 GSK3B (0.62) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4489308 0.82 GSK3B (0.62) GSK3BGSK3AFGFR4HDAC1HDAC2
SCHEMBL4494627 0.82 GSK3B (0.60) GSK3BGSK3ACDK2HDAC1HDAC2
SCHEMBL4503064 0.82 GSK3B (0.60) GSK3BGSK3AHDAC1HDAC2HDAC8
SCHEMBL4483353 0.81 GSK3B (0.70) GSK3BGSK3ACDK2CYP1A2

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