SCHEMBL23916356

SCHEMBL23916356

Cc1nnc(-c2ccc3cnc(NC(=O)c4ccnc(N5CCN(I)CC5)c4)cc3c2)s1

nearest known ligand 0.87

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.87
WNT1 P04628 16/20 0.87
GSK3B P49841 12/20 0.87
CLK2 P49760 2/20 0.64
CLK3 P49761 2/20 0.64

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
SCHEMBL19517451 0.93 DYRK1A (1.00) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540194 0.93 DYRK1A (0.87) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540247 0.91 DYRK1A (0.83) DYRK1AWNT1GSK3B
SCHEMBL19540453 0.91 DYRK1A (0.83) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540248 0.90 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL21214583 0.90 DYRK1A (0.91) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19539958 0.89 DYRK1A (0.82) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19539954 0.88 DYRK1A (0.85) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL19540195 0.88 DYRK1A (0.78) DYRK1AWNT1GSK3BCLK2CLK3
SCHEMBL23916887 0.88 WNT1 (0.87) 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