SCHEMBL8109993

SCHEMBL8109993

CC#CCOc1cc(-n2nc(C3CC3)sc2=O)c(F)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPOX P50336 15/20 0.36
POLB P06746 1/20 0.31
TPH1 P17752 1/20 0.31

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
SCHEMBL8110444 0.92 GAA (0.34) PPOXPOLB
SCHEMBL8100657 0.89 PPOX (0.35) PPOXPOLB
SCHEMBL8110702 0.83 PPOX (0.50) PPOXPOLB
SCHEMBL8116097 0.82 POLB (0.34) PPOXPOLB
SCHEMBL8116176 0.82 PPOX (0.48) PPOX
SCHEMBL8110417 0.81 PPOX (0.40) PPOXPOLBTPH1
SCHEMBL8110127 0.81 PPOX (0.35) PPOXPOLB
SCHEMBL8109978 0.79 PPOX (0.37) PPOXPOLB
SCHEMBL8110179 0.79 PPOX (0.38) PPOX
SCHEMBL8100821 0.79 PGK1 (0.35) PPOXPOLB

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