SCHEMBL23740812

SCHEMBL23740812

CN1CCC(C(=O)Nc2cc3cc(/C(=C/N)N(C)N)ccc3cn2)C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 19/20 0.54
GSK3B P49841 18/20 0.54
WNT1 P04628 7/20 0.53
ABL1 P00519 1/20 0.51

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
SCHEMBL23741020 0.95 DYRK1A (0.59) DYRK1AGSK3BWNT1
SCHEMBL23741143 0.93 DYRK1A (0.48) DYRK1AGSK3BWNT1
SCHEMBL23740986 0.88 GSK3B (0.58) DYRK1AGSK3BWNT1
SCHEMBL23741149 0.87 DYRK1A (0.59) DYRK1AGSK3BWNT1ABL1
SCHEMBL23740732 0.87 ABL1 (0.51) DYRK1AGSK3BWNT1ABL1
SCHEMBL23740943 0.87 GSK3B (0.62) DYRK1AGSK3BWNT1
SCHEMBL23740820 0.87 GSK3B (0.52) DYRK1AGSK3BWNT1ABL1
SCHEMBL23741024 0.86 GSK3B (0.55) DYRK1AGSK3BWNT1ABL1
SCHEMBL24219349 0.85 DYRK1A (0.46) DYRK1AGSK3BWNT1
SCHEMBL23740765 0.85 GSK3B (0.61) DYRK1AGSK3BWNT1

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