⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8827135 | 0.87 | — | — | |
| SCHEMBL8826498 | 0.87 | — | — | |
| SCHEMBL8826320 | 0.87 | — | — | |
| SCHEMBL431123 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL5670597 | 0.69 | — | — | |
| SCHEMBL111700 | 0.69 | — | — | |
| SCHEMBL818665 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL426215 | 0.67 | — | — | |
| SCHEMBL2400191 | 0.64 | — | — | |
| SCHEMBL7625639 | 0.64 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6218561-B1 | REACTING A MERCAPTOALKOXYSILANE WITH A N-ALKYLBIS(BENZOTHIAZOLSULFEN)AMIDE. | THE GOODYEAR TIRE & RUBBER COMPANY | 2001-04-17 | — | — | US | disclosed |
| US-5684171-A | FROM DITHIODIMORPHOLINE AND A MERCAPTOSILANE | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-11-04 | — | — | US | disclosed |
| US-5684172-A | REACTING BENZOTHIAZOLYL MORPHOLINYL DISULFIDE WITH A MERCAPTOALKYLALKOXYSILANE | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-11-04 | — | — | US | disclosed |
| US-5663358-A | Process for the preparation of organosilicon disulfide compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-09-02 | — | — | US | disclosed |
| EP-0785206-A1 | Process for the preparation of organosilicon disulfide compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-07-23 | — | — | EP | disclosed |