SCHEMBL23916600

SCHEMBL23916600

C/C=C(/Nc1cc2cc(-c3cnn(C)c3)ccc2cn1)c1ccc2cnccc2c1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.77
WNT1 P04628 17/20 0.77
CLK2 P49760 4/20 0.77
CLK3 P49761 4/20 0.77
GSK3B P49841 15/20 0.64
ABL1 P00519 1/20 0.55

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
SCHEMBL19516573 0.87 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL19547068 0.87 DYRK1A (0.79) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL23916596 0.85 DYRK1A (0.63) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL23916828 0.85 DYRK1A (0.61) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL23916167 0.81 GSK3B (0.79) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL23916733 0.81 GSK3B (0.79) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL19516601 0.79 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL31509872 0.79 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL31501389 0.78 DYRK1A (0.62) DYRK1AWNT1CLK2CLK3GSK3B
SCHEMBL25602112 0.78 DYRK1A (0.62) DYRK1AWNT1CLK2CLK3GSK3B

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