SCHEMBL17586343

SCHEMBL17586343

Nc1c(F)c(NCCCc2ccccn2)c2c3c1c(=O)c(C1=NNNN1)cn3C1(CCCC1)CO2

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 20/20 0.57

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
SCHEMBL8092388 0.85 GSK3B (0.57) GSK3B
SCHEMBL12874309 0.85 GSK3B (0.59) GSK3B
SCHEMBL12874255 0.85 GSK3B (0.64) GSK3B
SCHEMBL12874260 0.84 GSK3B (0.64) GSK3B
SCHEMBL8091843 0.83 GSK3B (0.68) GSK3B
SCHEMBL1186424 0.83 GSK3B (0.81) GSK3B
SCHEMBL12874295 0.83 GSK3B (0.72) GSK3B
SCHEMBL12874426 0.83 GSK3B (0.63) GSK3B
Hydrochloric Acid SCHEMBL15401354 0.83 GSK3B (0.67) GSK3B
SCHEMBL12874424 0.82 GSK3B (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203459-B1 SPIROCYCLIC AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2016-03-16 EP disclosed