⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6960144 | 0.80 | — | — | |
| SCHEMBL6970683 | 0.78 | CES2 (0.43) | — | |
| SCHEMBL3266708 | 0.78 | MGLL (0.41) | — | |
| SCHEMBL11289157 | 0.77 | THRB (0.42) | — | |
| SCHEMBL10571256 | 0.77 | THRB (0.42) | — | |
| SCHEMBL6967004 | 0.77 | — | — | |
| SCHEMBL35565 | 0.77 | THRB (0.42) | — | |
| SCHEMBL35363 | 0.77 | THRB (0.42) | — | |
| SCHEMBL11170048 | 0.77 | THRB (0.42) | — | |
| SCHEMBL3260589 | 0.77 | — | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0825247-A2 | Compositions containing thiocarbonates and acylated-nitrogen containing compounds | The Lubrizol Corporation (US) | 1998-02-25 | — | — | EP | disclosed |
| EP-0202054-B1 | PRODUCTION OF S-ARYL S-ALKYL DITHIOCARBONATES, ARENETHIOLS AND ARYTHIOETHERS | COURTAULDS PLC (GB) | 1990-07-25 | — | — | EP | disclosed |
| US-4711967-A | PYROLYTICALLY ISOMERIZING AND O-ARYL S-ALKYL DITHIOCARBONATE | COURTAULDS PLC (GB) | 1987-12-08 | — | — | US | disclosed |
| EP-0202054-A1 | Production of S-aryl S-alkyl dithiocarbonates, arenethiols and arythioethers | COURTAULDS PLC (GB) | 1986-11-20 | — | — | EP | disclosed |
| US-4108949-A | 6-Hydroxy (alkoxy) phenylthiomethylene di(organophosphorus) compounds and process for making same | MONSANTO COMPANY (US) | 1978-08-22 | — | — | US | disclosed |
| US-4071584-A | Hydroxyphenylthiophosphoranylidene organophosphorus compounds | MONSANTO COMPANY (US) | 1978-01-31 | — | — | US | disclosed |