SCHEMBL4486353

SCHEMBL4486353

CCCC(=O)Nc1n[nH]c2cc(-c3cccc(NC(C)=O)c3)ccc12

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 19/20 0.76
AAK1 Q2M2I8 1/20 0.70
CYP1A2 P05177 3/20 0.69

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
SCHEMBL4479634 0.86 AAK1 (0.67) GSK3BAAK1CYP1A2
SCHEMBL4493121 0.86 GSK3B (1.00) GSK3BCYP1A2
SCHEMBL31060453 0.86 GSK3B (1.00) GSK3BCYP1A2
SCHEMBL31060134 0.85 GSK3B (1.00) GSK3BAAK1CYP1A2
SCHEMBL6485118 0.85 GSK3B (1.00) GSK3BAAK1CYP1A2
SCHEMBL4484161 0.85 AAK1 (0.64) GSK3BAAK1CYP1A2
SCHEMBL4499076 0.84 GSK3B (0.83) GSK3BCYP1A2
SCHEMBL12886082 0.83 AAK1 (0.66) GSK3BAAK1CYP1A2
SCHEMBL4488792 0.83 AAK1 (0.68) GSK3BAAK1CYP1A2
SCHEMBL4497459 0.83 GSK3B (0.69) GSK3BCYP1A2

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