SCHEMBL28842992

SCHEMBL28842992

CCSC1=NC(=O)C(=Cc2ccc3ncsc3c2)N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 20/20 0.54
▸ DYRK1A Q13627 20/20 0.54
▸ DYRK1B Q9Y463 20/20 0.54
▸ DYRK2 Q92630 18/20 0.54
▸ CSNK2A2 P19784 2/20 0.54
▸ CSNK2B P67870 2/20 0.54
▸ CSNK2A1 P68400 2/20 0.54
▸ CLK4 Q9HAZ1 19/20 0.53
▸ CLK2 P49760 18/20 0.53
▸ CLK3 P49761 18/20 0.53
▸ DYRK3 O43781 16/20 0.53
▸ DYRK4 Q9NR20 16/20 0.53
▸ GSK3B P49841 14/20 0.53
▸ CDK5 Q00535 1/20 0.53
▸ CDK5R1 Q15078 1/20 0.53
▸ PIK3CD O00329 1/20 0.47
▸ PRKCB P05771 1/20 0.47
▸ PIK3CA P42336 1/20 0.47
▸ PIK3CG P48736 1/20 0.47
▸ HASPIN Q8TF76 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
SCHEMBL23510449 1.00 CLK1 (0.54) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL26136808 0.87 CLK1 (0.55) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL26133684 0.87 CLK1 (0.55) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL30145002 0.84 CLK1 (0.60) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL28842886 0.84 CLK1 (0.60) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL23510493 0.84 CLK1 (0.60) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL23510596 0.76 KDM4E (0.59) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL23510452 0.73 CLK1 (0.54) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL24904286 0.72 DYRK1A (0.59) CLK1DYRK1ADYRK1BDYRK2CSNK2A2
SCHEMBL30144962 0.71 CLK1 (0.60) CLK1DYRK1ADYRK1BDYRK2CSNK2A2

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
CN-114929690-B Novel heterocyclic derivatives having cardiomyocyte proliferative activity for the treatment of heart disease 同济大学 2023-05-05 — — CN disclosed
CN-114929690-A Novel heterocyclic derivatives with cardiomyocyte proliferative activity for the treatment of cardiac diseases 同济大学 2022-08-19 — — CN disclosed
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