SCHEMBL8109978

SCHEMBL8109978

C#CCOc1cc(-n2nc(C3CC3)sc2=O)c(Cl)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.37
POLB P06746 1/20 0.35
PGK1 P00558 1/20 0.34
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.30
TP53 P04637 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL8100657 0.91 PPOX (0.35) PPOXPOLBPGK1MAPT
SCHEMBL8100821 0.91 PGK1 (0.35) PPOXPOLBPGK1MAPTKMT2A
SCHEMBL8110127 0.91 PPOX (0.35) PPOXPOLBMAPT
SCHEMBL8110674 0.91 PPOX (0.35) PPOXPOLBMAPTKMT2A
SCHEMBL8116097 0.88 POLB (0.34) PPOXPOLBMAPTGAAPKM
SCHEMBL8110444 0.87 GAA (0.34) PPOXPOLBMAPTGAAPKM
SCHEMBL8100717 0.83 PPOX (0.46) PPOXPOLBMAPTGAAPKM
SCHEMBL8110190 0.81 PPOX (0.36) PPOXPOLBMAPTGAAPKM
SCHEMBL8110461 0.81 PPOX (0.39) PPOXPOLBMAPTLMNAKMT2A
SCHEMBL8100813 0.80 PPOX (0.45) PPOXPOLBMAPT

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