SCHEMBL4483748

SCHEMBL4483748

Cc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 5/20 0.78
GSK3B P49841 5/20 0.78
AAK1 Q2M2I8 14/20 0.77
CDK2 P24941 2/20 0.71
PIK3CD O00329 1/20 0.71
PIM1 P11309 1/20 0.71
HDAC1 Q13547 1/20 0.69
HDAC2 Q92769 1/20 0.69
HDAC8 Q9BY41 1/20 0.69
GAK O14976 2/20 0.67
STK16 O75716 2/20 0.67
BMP2K Q9NSY1 2/20 0.67

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
SCHEMBL4488385 0.95 GSK3A (0.71) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4494840 0.94 GSK3A (0.70) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4502153 0.91 AAK1 (0.74) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4484280 0.89 AAK1 (0.80) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4500013 0.88 GSK3A (1.00) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL12292788 0.87 AAK1 (0.87) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4480360 0.86 AAK1 (0.82) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4487011 0.86 AAK1 (0.67) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4491681 0.86 GSK3B (1.00) GSK3AGSK3BAAK1CDK2PIK3CD
SCHEMBL4496007 0.86 AAK1 (0.67) GSK3AGSK3BAAK1CDK2PIK3CD

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 4 patents. 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
EP-1506176-B1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2013-04-24 EP disclosed
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 disclosed
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 disclosed