SCHEMBL23741024

SCHEMBL23741024

CN(N)/C(=C\N)c1ccc2cnc(NC(=O)C3CCNCC3)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 18/20 0.55
DYRK1A Q13627 18/20 0.55
WNT1 P04628 9/20 0.55
ABL1 P00519 2/20 0.48
CLK2 P49760 1/20 0.47
CLK3 P49761 1/20 0.47

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
SCHEMBL23741019 0.95 DYRK1A (0.52) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23740820 0.91 GSK3B (0.52) GSK3BDYRK1AWNT1ABL1
SCHEMBL23741020 0.88 DYRK1A (0.59) GSK3BDYRK1AWNT1
SCHEMBL23741143 0.87 DYRK1A (0.48) GSK3BDYRK1AWNT1
SCHEMBL23740986 0.87 GSK3B (0.58) GSK3BDYRK1AWNT1
SCHEMBL23740732 0.86 ABL1 (0.51) GSK3BDYRK1AWNT1ABL1CLK2
SCHEMBL23741149 0.86 DYRK1A (0.59) GSK3BDYRK1AWNT1ABL1CLK2
SCHEMBL23740812 0.86 DYRK1A (0.54) GSK3BDYRK1AWNT1ABL1
SCHEMBL24219028 0.85 DYRK1A (0.40) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23741017 0.84 GSK3B (0.55) GSK3BDYRK1AWNT1ABL1CLK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3943086-A1 ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF BioSplice Therapeutics, Inc. (US) 2022-01-26 EP disclosed
EP-3448838-B1 ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF BIOSPLICE THERAPEUTICS INC (US) 2021-08-11 EP disclosed