SCHEMBL23916189

SCHEMBL23916189

Cc1ncc(-c2ccc3cnc(NC(=O)c4cccc(CN5CCCC5)c4)cc3c2)s1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.72
GSK3B P49841 16/20 0.72
WNT1 P04628 16/20 0.72
CLK2 P49760 2/20 0.68
CLK3 P49761 2/20 0.68

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
SCHEMBL19540426 0.90 DYRK1A (0.69) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23048886 0.88 DYRK1A (0.68) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19540412 0.88 GSK3B (0.70) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL30003768 0.83 DYRK1A (1.00) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19517385 0.83 DYRK1A (1.00) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19517084 0.82 GSK3B (1.00) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL30005223 0.82 GSK3B (1.00) DYRK1AGSK3BWNT1
SCHEMBL19515527 0.82 GSK3B (1.00) DYRK1AGSK3BWNT1
SCHEMBL19540399 0.81 GSK3B (0.77) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19540427 0.81 DYRK1A (0.70) DYRK1AGSK3BWNT1CLK2CLK3

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