SCHEMBL23916726

SCHEMBL23916726

C=C(N)S/C(=C\C)c1ccc2cnc(NC(=S)c3ccc(CC(C)C)cc3)cc2c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.40
DYRK1A Q13627 6/20 0.31
GSK3B P49841 4/20 0.31
CLK2 P49760 3/20 0.31
CLK3 P49761 3/20 0.31
WNT1 P04628 2/20 0.31

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
SCHEMBL23048669 0.78 NNMT (0.38) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL23916939 0.76 DYRK1A (0.44) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL23916680 0.74 ABL1 (0.45) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL23916185 0.73 DYRK1A (0.37) ABL1DYRK1AGSK3BWNT1
SCHEMBL23916234 0.70 ABL1 (0.41) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL23916731 0.69 DYRK1A (0.54) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL23916770 0.67 DYRK1A (0.62) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL23916169 0.64 ABL1 (0.45) ABL1DYRK1AGSK3BCLK2CLK3
SCHEMBL19546601 0.64 DYRK1A (0.61) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL20938652 0.63 DYRK1A (0.48) DYRK1AGSK3BCLK2CLK3WNT1

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