SCHEMBL23916781

SCHEMBL23916781

C=C(Nc1cc2cc(-c3cnn(C)c3)ccc2cn1)c1ccc2c(cnn2C)c1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.79
WNT1 P04628 16/20 0.79
GSK3B P49841 15/20 0.79
CLK2 P49760 4/20 0.79
CLK3 P49761 4/20 0.79

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
SCHEMBL19517201 0.88 DYRK1A (1.00) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19547068 0.85 DYRK1A (0.79) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546979 0.85 DYRK1A (0.80) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916601 0.83 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916812 0.83 DYRK1A (0.72) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916760 0.83 DYRK1A (0.79) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916328 0.83 DYRK1A (0.65) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546636 0.83 DYRK1A (0.80) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916248 0.83 DYRK1A (0.80) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19547062 0.82 DYRK1A (0.60) DYRK1AWNT1GSK3BCLK2CLK3

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