SCHEMBL4499724

SCHEMBL4499724

Cc1ccc(-c2ccc3c(NC(=O)NCCN)n[nH]c3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 17/20 0.62
ABL1 P00519 1/20 0.56
BCR P11274 1/20 0.56
HDAC6 Q9UBN7 1/20 0.50
AAK1 Q2M2I8 2/20 0.48
CYP1A2 P05177 1/20 0.48
GSK3A P49840 2/20 0.48
PIK3CD O00329 1/20 0.48
PIM1 P11309 1/20 0.48
CDK2 P24941 1/20 0.48

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
SCHEMBL4492939 0.93 GSK3B (0.60) GSK3BABL1BCRHDAC6AAK1
SCHEMBL4488734 0.90 GSK3B (0.53) GSK3BABL1HDAC6AAK1CYP1A2
SCHEMBL4497067 0.90 GSK3B (0.64) GSK3BABL1BCRCYP1A2
SCHEMBL4558529 0.89 GSK3B (0.65) GSK3BABL1BCRHDAC6AAK1
SCHEMBL4503672 0.88 HDAC6 (0.61) GSK3BHDAC6
SCHEMBL4492112 0.88 GSK3B (0.61) GSK3BABL1BCRHDAC6CYP1A2
SCHEMBL4480331 0.88 GSK3B (0.61) GSK3BABL1BCRCYP1A2
SCHEMBL12886269 0.85 GSK3B (0.58) GSK3BABL1BCRHDAC6CYP1A2
SCHEMBL12886030 0.85 GSK3B (0.53) GSK3BABL1HDAC6GSK3A
SCHEMBL4486390 0.84 GSK3B (0.62) GSK3BABL1BCRHDAC6AAK1

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