SCHEMBL30673142

SCHEMBL30673142

O=c1c(NCCc2ccncc2)c(Nc2ccc(Cl)cc2)c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.67
CHEK2 O96017 6/20 0.67
PRKACA P17612 6/20 0.67
RPS6KB1 P23443 6/20 0.67
GSK3A P49840 6/20 0.67
RPS6KA3 P51812 6/20 0.67
ROCK1 Q13464 6/20 0.67
PRKG1 Q13976 6/20 0.67
PKN2 Q16513 6/20 0.67
CDC42BPA Q5VT25 6/20 0.67
HIPK4 Q8NE63 6/20 0.67
AURKB Q96GD4 6/20 0.67
CSNK1G3 Q9Y6M4 6/20 0.67
CHEK1 O14757 5/20 0.67
MKNK2 Q9HBH9 5/20 0.67
SGK2 Q9HBY8 5/20 0.67
AKT1 P31749 5/20 0.67
NEK4 P51957 4/20 0.67
PRKCD Q05655 4/20 0.67
CSNK1G2 P78368 4/20 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
SCHEMBL4369721 0.94 GSK3A (0.75) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL4376009 0.90 FLT4 (0.71) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL27249149 0.90 AURKB (0.58) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL4026017 0.87 FLT4 (0.80) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL30673004 0.86 MEN1 (0.62) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL30672966 0.83 CHEK2 (0.52) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL30673085 0.83 FLT4 (0.52) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL30672911 0.83 KMT2A (0.52) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL4364173 0.83 FLT4 (0.79) GSK3BCHEK2PRKACARPS6KB1GSK3A
SCHEMBL30672940 0.83 CNR1 (0.55) GSK3BCHEK2PRKACARPS6KB1GSK3A

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
CN-119325464-A Square amide derivatives as CB1 allosteric modulators 研究三角协会 2025-01-17 CN claimed
EP-4532463-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS Research Triangle Institute (US) 2025-04-09 EP disclosed
CN-119325464-A Square amide derivatives as CB1 allosteric modulators 研究三角协会 2025-01-17 CN disclosed
WO-2023235548-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RESEARCH TRIANGLE INSTITUTE (US) 2023-12-07 WO disclosed