SCHEMBL29239083

SCHEMBL29239083

O=c1sn(-c2cccc3ccccc23)c(=O)n1Cc1ccc(Cl)cc1

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.83
HDAC6 Q9UBN7 1/20 0.83
RGS4 P49798 15/20 0.60
RGS8 P57771 15/20 0.60
GSK3A P49840 2/20 0.43
DAPK3 O43293 1/20 0.43
FLT1 P17948 1/20 0.43
DYRK1A Q13627 1/20 0.43

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
Tideglusib SCHEMBL676929 0.91 GSK3B (1.00) GSK3BHDAC6RGS4RGS8GSK3A
Tideglusib SCHEMBL29357303 0.91 GSK3B (1.00) GSK3BHDAC6RGS4RGS8GSK3A
SCHEMBL29239076 0.89 GSK3B (0.81) GSK3BHDAC6RGS4RGS8
SCHEMBL29239075 0.89 GSK3B (0.81) GSK3BHDAC6RGS4RGS8
SCHEMBL29239080 0.89 GSK3B (0.81) GSK3BHDAC6RGS4RGS8GSK3A
SCHEMBL30893120 0.88 GSK3B (0.76) GSK3BHDAC6RGS4RGS8DAPK3
SCHEMBL29239094 0.88 GSK3B (0.76) GSK3BHDAC6RGS4RGS8DAPK3
SCHEMBL29239096 0.85 GSK3B (0.80) GSK3BHDAC6RGS4RGS8GSK3A
SCHEMBL30893121 0.81 GSK3B (0.77) GSK3BHDAC6RGS4RGS8GSK3A
SCHEMBL29239085 0.81 GSK3B (0.77) GSK3BHDAC6RGS4RGS8GSK3A

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
CN-113827592-B Application of thiadiazolidinedione compound in treating pathogenic infection 中国科学院上海药物研究所 2024-06-18 CN disclosed