⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28930420 | 0.91 | ALDH1A1 (0.35) | — | |
| SCHEMBL27852650 | 0.74 | — | — | |
| SCHEMBL28048504 | 0.74 | — | — | |
| SCHEMBL3095657 | 0.69 | — | — | |
| SCHEMBL10705733 | 0.69 | — | — | |
| SCHEMBL938362 | 0.69 | — | — | |
| SCHEMBL27672153 | 0.69 | — | — | |
| SCHEMBL28757792 | 0.67 | — | — | |
| Selenium SCHEMBL31729507 | 0.67 | — | — | |
| SCHEMBL16021870 | 0.65 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7402689-B2 | Vinylchloroformate-free synthesis of vinyl and allyl(thio) carbamates | BAUSCH & LOMB INCORPORATED (US) | 2008-07-22 | — | — | US | claimed |
| EP-1708989-A1 | VINYLCHLOROFORMATE-FREE SYNTHESIS OF VINYL AND ALLYL(THIO)CARBAMATES | BAUSCH & LOMB INCORPORATED (US) | 2006-10-11 | — | — | EP | claimed |
| WO-2005073181-A1 | VINYLCHLOROFORMATE-FREE SYNTHESIS OF VINYL AND ALLYL(THIO)CARBAMATES | BAUSCH & LOMB INCORPORATED (US) | 2005-08-11 | — | — | WO | claimed |
| US-20050176980-A1 | Vinylchloroformate-free synthesis of vinyl and allyl(thio) carbamates | BAUSCH & LOMB INCORPORATED | 2005-08-11 | — | — | US | claimed |
| WO-2013003318-A1 | PROCESS FOR PREPARING VINYL CHLOROFORMATE | BAUSCH & LOMB INCORPORATED (US) | 2013-01-03 | — | — | WO | disclosed |
| US-8273914-B1 | Process for preparing vinyl chloroformate | BAUSCH & LOMB INCORPORATED (US) | 2012-09-25 | — | — | US | disclosed |
| US-7402689-B2 | Vinylchloroformate-free synthesis of vinyl and allyl(thio) carbamates | BAUSCH & LOMB INCORPORATED (US) | 2008-07-22 | — | — | US | disclosed |
| EP-1892237-A1 | Vinylchloroformate-free synthesis of vinyl and allyl(thio)carbamates | Bausch & Lomb Incorporated (US) | 2008-02-27 | — | — | EP | disclosed |
| US-20050176980-A1 | Vinylchloroformate-free synthesis of vinyl and allyl(thio) carbamates | BAUSCH & LOMB INCORPORATED | 2005-08-11 | — | — | US | disclosed |