SCHEMBL23916374

SCHEMBL23916374

CN(N)/C=C(\N)c1ccc2cnc(NC(=O)c3ccc4c(c3)CCN(C)C4)cc2c1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.64
WNT1 P04628 14/20 0.64
GSK3B P49841 13/20 0.64
CLK2 P49760 6/20 0.61
CLK3 P49761 6/20 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
SCHEMBL23048642 0.84 WNT1 (0.62) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23048782 0.82 DYRK1A (0.65) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23048843 0.82 DYRK1A (0.65) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23048730 0.81 DYRK1A (0.64) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916457 0.80 DYRK1A (0.65) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23048735 0.79 DYRK1A (0.64) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23048925 0.79 DYRK1A (0.63) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL24219006 0.79 DYRK1A (0.58) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23740826 0.79 DYRK1A (0.58) DYRK1AWNT1GSK3B
SCHEMBL19517518 0.78 DYRK1A (1.00) 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