SCHEMBL23916829

SCHEMBL23916829

C=C(Nc1cc2cc(-c3cncn3C)ccc2cn1)c1cccc(OC2CCN(C)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 20/20 0.61
DYRK1A Q13627 20/20 0.61
WNT1 P04628 16/20 0.61
CLK2 P49760 1/20 0.52
CLK3 P49761 1/20 0.52

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
SCHEMBL23916306 0.92 GSK3B (0.59) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL19540360 0.90 DYRK1A (0.75) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23916849 0.88 DYRK1A (0.61) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23916305 0.86 GSK3B (0.82) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23916392 0.85 GSK3B (0.83) GSK3BDYRK1AWNT1
SCHEMBL23916590 0.85 GSK3B (0.59) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23916292 0.84 DYRK1A (0.61) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL19540434 0.83 GSK3B (0.73) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23916841 0.83 DYRK1A (0.61) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL19540292 0.82 GSK3B (0.77) GSK3BDYRK1AWNT1CLK2CLK3

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-3892276-A1 ISOQUINOLIN-3-YL CARBOXAMIDES AS WNT INHIBITORS BioSplice Therapeutics, Inc. (US) 2021-10-13 EP disclosed