SCHEMBL4073949

SCHEMBL4073949

CC1COc2c(NCCCn3ccnc3)c(F)c(N)c3c(=O)c(C(N)=O)cn1c23

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 20/20 1.00

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
SCHEMBL1345046 1.00 GSK3B (1.00) GSK3B
SCHEMBL12131700 0.95 GSK3B (0.90) GSK3B
SCHEMBL12130849 0.94 GSK3B (1.00) GSK3B
SCHEMBL16317153 0.94 GSK3B (1.00) GSK3B
SCHEMBL12130829 0.94 GSK3B (1.00) GSK3B
SCHEMBL12131722 0.89 GSK3B (0.80) GSK3B
SCHEMBL1344988 0.86 GSK3B (1.00) GSK3B
SCHEMBL12131726 0.86 GSK3B (0.75) GSK3B
SCHEMBL12130895 0.85 GSK3B (0.84) GSK3B
SCHEMBL1345449 0.85 GSK3B (0.84) GSK3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013182-B1 AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-09-04 EP disclosed
EP-2013182-A2 AMINOQUINOLONES AS GSK-3 INHIBITORS Activx Biosciences, Inc. (US) 2009-01-14 EP disclosed
WO-2007106537-A2 AMINOQUINOLONES AS GSK-3 INHIBITORS ACTIVX BIOSCIENCES, INC. (US) 2007-09-20 WO disclosed