SCHEMBL4499397

SCHEMBL4499397

CC(=O)Nc1n[nH]c2cc(-c3ccc(C)cc3)ccc12

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.70
DYRK1A Q13627 1/20 0.64
LMNA P02545 1/20 0.58
HDAC6 Q9UBN7 2/20 0.58
AAK1 Q2M2I8 4/20 0.58
GSK3A P49840 2/20 0.56
PIK3CD O00329 1/20 0.56
PIM1 P11309 1/20 0.56
CDK2 P24941 1/20 0.56
FGFR1 P11362 1/20 0.55
FGFR2 P21802 1/20 0.55
FGFR3 P22607 1/20 0.55

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
SCHEMBL4500909 0.90 HDAC6 (0.70) GSK3BDYRK1AHDAC6AAK1GSK3A
SCHEMBL4487525 0.89 GSK3B (0.73) GSK3BDYRK1AHDAC6AAK1GSK3A
SCHEMBL13524671 0.88 DYRK1A (0.71) GSK3BDYRK1ALMNAHDAC6AAK1
SCHEMBL4499351 0.88 DYRK1A (0.63) GSK3BDYRK1AHDAC6AAK1GSK3A
SCHEMBL4491401 0.88 GSK3B (0.73) GSK3BDYRK1AAAK1GSK3APIK3CD
SCHEMBL4480790 0.86 DYRK1A (0.57) GSK3BDYRK1ALMNAHDAC6AAK1
SCHEMBL4558529 0.85 GSK3B (0.65) GSK3BDYRK1AHDAC6AAK1GSK3A
SCHEMBL4483349 0.85 GSK3B (0.74) GSK3BDYRK1AHDAC6AAK1GSK3A
SCHEMBL4494131 0.85 HDAC6 (0.71) GSK3BDYRK1AHDAC6AAK1
SCHEMBL4489321 0.85 GSK3B (0.76) GSK3B

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