SCHEMBL4489015

SCHEMBL4489015

CSc1ccccc1-c1ccc2c(NC(=O)C3CCCCC3)n[nH]c2c1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 0.64
GSK3A P49840 8/20 0.64
AAK1 Q2M2I8 11/20 0.58
CDK2 P24941 5/20 0.58
PIK3CD O00329 1/20 0.58
PIM1 P11309 1/20 0.58

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
SCHEMBL4485400 0.99 GSK3B (0.65) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4483953 0.97 GSK3B (0.65) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4495973 0.95 GSK3B (0.71) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4497986 0.86 GSK3B (0.69) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4487511 0.85 HDAC6 (0.65) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4484157 0.85 GSK3B (0.53) GSK3BGSK3AAAK1
SCHEMBL4490055 0.84 GSK3A (0.88) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4492327 0.84 HDAC6 (0.66) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4485396 0.84 GSK3B (0.69) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL4493490 0.84 GSK3B (0.72) GSK3BGSK3AAAK1CDK2PIK3CD

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