⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5862214 | 0.77 | — | — | |
| SCHEMBL461677 | 0.75 | — | — | |
| SCHEMBL1907620 | 0.73 | — | — | |
| SCHEMBL1765840 | 0.73 | — | — | |
| SCHEMBL1907146 | 0.73 | — | — | |
| SCHEMBL1903985 | 0.73 | — | — | |
| SCHEMBL1766010 | 0.73 | — | — | |
| SCHEMBL1766026 | 0.73 | — | — | |
| SCHEMBL958738 | 0.69 | — | — | |
| SCHEMBL11031979 | 0.68 | MITF (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7049456-B2 | Method for preparing O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP (US) | 2006-05-23 | — | — | US | claimed |
| US-20040176629-A1 | Method for preparing O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-09-09 | — | — | US | claimed |
| US-20040167348-A1 | Methods for purifying O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-08-26 | — | — | US | claimed |
| US-7049456-B2 | Method for preparing O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP (US) | 2006-05-23 | — | — | US | disclosed |
| US-20040176629-A1 | Method for preparing O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-09-09 | — | — | US | disclosed |
| US-20040176629-A1 | Method for preparing O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-09-09 | — | — | US | disclosed |
| US-20040167348-A1 | Methods for purifying O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-08-26 | — | — | US | disclosed |
| US-20040167348-A1 | Methods for purifying O,O-dialkyl S-[2-(alkylthio)alkyl] phosphorodithioates | BAYER CROPSCIENCE LP | 2004-08-26 | — | — | US | disclosed |