SCHEMBL14722003

SCHEMBL14722003

COc1ccc2c(c1)c(C1=C(Nc3ccccc3)C(=O)NC1=O)cn2C(C)(C)CCN

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.48
STK10 O94804 7/20 0.47
SLK Q9H2G2 7/20 0.47
PRKCB P05771 7/20 0.45
PRKCA P17252 6/20 0.44
PRKCE Q02156 4/20 0.43

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
SCHEMBL14722002 0.83 PRKCB (0.55) GSK3BSTK10SLKPRKCBPRKCA
SCHEMBL7844233 0.77 PRKCB (0.74) GSK3BPRKCBPRKCAPRKCE
SCHEMBL7840192 0.76 PRKCA (0.76) GSK3BPRKCBPRKCAPRKCE
SCHEMBL7839690 0.72 JAK2 (0.77) GSK3BPRKCBPRKCAPRKCE
SCHEMBL5819295 0.71 PRKCB (0.74) GSK3BSTK10SLKPRKCBPRKCA
SCHEMBL14721745 0.71 PRKCB (0.52) GSK3BPRKCBPRKCAPRKCE
SCHEMBL7781089 0.67 GSK3B (1.00) GSK3BSTK10SLK
SCHEMBL7502631 0.66 GSK3B (0.70) GSK3BPRKCA
SCHEMBL8161651 0.66 GSK3B (0.80) GSK3BPRKCA
SCHEMBL9085883 0.65 PRKD1 (0.79) GSK3BPRKCBPRKCAPRKCE

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
WO-2013029043-A1 SELECTIVE KINASE INHIBITORS REACTION BIOLOGY CORP. (US) 2013-02-28 WO disclosed