SCHEMBL23916660

SCHEMBL23916660

C=C(Nc1cc2cc(-c3cnn(C)c3CN3CCCCC3)ccc2cn1)c1ccnc(N2CC(N(C)C)C2)c1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.66
GSK3B P49841 19/20 0.66
WNT1 P04628 19/20 0.66
CLK2 P49760 5/20 0.60
CLK3 P49761 5/20 0.60

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
SCHEMBL23916667 0.89 DYRK1A (0.72) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916662 0.87 DYRK1A (0.68) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916409 0.87 DYRK1A (0.72) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916633 0.86 DYRK1A (0.68) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19546652 0.86 DYRK1A (0.84) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916648 0.86 DYRK1A (0.61) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916134 0.85 DYRK1A (0.68) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL19539770 0.85 DYRK1A (0.84) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916679 0.84 GSK3B (0.57) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL23916272 0.83 GSK3B (0.58) 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