SCHEMBL4492471

SCHEMBL4492471

Cc1ccc(C)c(-c2ccc3c(NC(=O)Cc4ccccc4)n[nH]c3c2)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 0.57
CDK2 P24941 4/20 0.53
HDAC1 Q13547 4/20 0.50
HDAC2 Q92769 4/20 0.50
HDAC8 Q9BY41 4/20 0.50
AURKB Q96GD4 1/20 0.48
STK17A Q9UEE5 1/20 0.48
MAPK1 P28482 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
SCHEMBL4485485 0.90 GSK3B (0.60) GSK3BHDAC1HDAC2HDAC8
SCHEMBL4502174 0.88 GSK3B (0.56) GSK3BHDAC1HDAC2HDAC8AURKB
SCHEMBL4483435 0.88 GSK3B (0.72) GSK3BCDK2HDAC1HDAC2HDAC8
SCHEMBL4480712 0.88 HDAC1 (0.56) GSK3BCDK2HDAC1HDAC2HDAC8
SCHEMBL4482695 0.87 GSK3B (0.64) GSK3BCDK2HDAC1HDAC2HDAC8
SCHEMBL4506246 0.85 GSK3B (0.67) GSK3B
SCHEMBL4484894 0.84 GSK3B (0.53) GSK3BCDK2AURKB
SCHEMBL4480196 0.84 FGFR1 (0.65) GSK3B
SCHEMBL4497978 0.84 GSK3B (0.57) GSK3BHDAC1HDAC2HDAC8
SCHEMBL4480790 0.82 DYRK1A (0.57) GSK3BCDK2

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