SCHEMBL32679836

SCHEMBL32679836

CCS(=O)(=O)c1nc2c(C)cccc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.56
▸ PKM P14618 1/20 0.49
▸ GAA P10253 1/20 0.48
▸ MAPT P10636 8/20 0.47
▸ LMNA P02545 4/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ ACP1 P24666 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ MEN1 O00255 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ HTT P42858 3/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL27527885 0.82 ALDH1A1 (0.53) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL27658693 0.78 PKM (0.60) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL29194931 0.78 ALDH1A1 (0.42) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL6014083 0.77 PKM (0.52) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL9637250 0.76 PKM (0.40) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL29194941 0.75 ALDH1A1 (0.45) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL3595617 0.75 ALDH1A1 (0.67) ALDH1A1PKMMAPTLMNAMEN1
SCHEMBL30149949 0.75 ALDH1A1 (0.67) ALDH1A1PKMMAPTLMNAMEN1
SCHEMBL805050 0.73 ALDH1A1 (0.58) ALDH1A1PKMGAAMAPTLMNA
SCHEMBL29459319 0.72 CA2 (0.38) ALDH1A1PKMMAPTLMNAMEN1

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-121574107-A Method for synthesizing aryl thiobenzothiazole compound based on cuprous chloride 苏州大学 2026-02-27 — — CN claimed
CN-121574107-A Method for synthesizing aryl thiobenzothiazole compound based on cuprous chloride 苏州大学 2026-02-27 — — CN disclosed
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