SCHEMBL23916710

SCHEMBL23916710

C=C(Nc1cc2cc(-c3ncc(C(=C)NC)s3)ccc2cn1)c1ccnc(N2CCN(C)CC2)c1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.70
WNT1 P04628 13/20 0.70
GSK3B P49841 10/20 0.61
CLK2 P49760 2/20 0.58
CLK3 P49761 2/20 0.58

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
SCHEMBL23048930 0.86 DYRK1A (0.85) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916279 0.84 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546935 0.83 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546974 0.83 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19516590 0.83 DYRK1A (1.00) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL32665112 0.83 DYRK1A (1.00) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19546610 0.82 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19547058 0.82 DYRK1A (0.81) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916239 0.82 DYRK1A (0.71) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916178 0.81 DYRK1A (0.82) 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