SCHEMBL8109448

SCHEMBL8109448

C#CCOc1cc(-n2nc(C(C)(C)C)sc2=O)c(C)cc1Cl

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPOX P50336 16/20 0.51
PGK1 P00558 1/20 0.36

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
SCHEMBL8101225 0.91 PPOX (0.57) PPOXPGK1
SCHEMBL8109941 0.88 PPOX (0.55) PPOX
SCHEMBL8109449 0.88 PPOX (0.55) PPOXPGK1
SCHEMBL8116165 0.84 PPOX (0.55) PPOXPGK1
SCHEMBL8110343 0.84 PPOX (0.55) PPOX
SCHEMBL8114446 0.84 PPOX (0.55) PPOX
SCHEMBL8101016 0.82 PPOX (0.53) PPOX
SCHEMBL8110042 0.82 PPOX (0.48) PPOXPGK1
SCHEMBL8116525 0.82 PPOX (0.47) PPOXPGK1
SCHEMBL8100821 0.81 PGK1 (0.35) PPOXPGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780385-B1 Arylthiadiazolones with a herbicidal activity ISAGRO RICERCA SRL (IT) 2000-05-10 EP disclosed
US-5821197-A CYCLIZATION OF A THIOHYDRAZIDE ISAGRO RICERCA S.R.L. (IT) 1998-10-13 US disclosed
EP-0780385-A1 Arylthiadiazolones with a herbicidal activity ISAGRO RICERCA S.r.l. (IT) 1997-06-25 EP disclosed