SCHEMBL23916165

SCHEMBL23916165

C=C(Nc1cc2cc(-c3cnc(N)s3)ccc2cn1)c1ccnc(N2CC(N(C)C)C2)c1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.68
WNT1 P04628 17/20 0.67
GSK3B P49841 15/20 0.67
CLK2 P49760 2/20 0.61
CLK3 P49761 2/20 0.61

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
SCHEMBL23916315 0.90 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540170 0.90 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916644 0.90 DYRK1A (0.64) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916301 0.90 DYRK1A (0.83) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546972 0.89 DYRK1A (0.66) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546610 0.86 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916811 0.86 DYRK1A (0.68) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546612 0.84 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546550 0.83 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540448 0.83 DYRK1A (0.78) 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