⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5691 | 0.94 | — | — | |
| SCHEMBL8949845 | 0.94 | — | — | |
| SCHEMBL8198723 | 0.94 | — | — | |
| SCHEMBL7665665 | 0.88 | — | — | |
| SCHEMBL11054248 | 0.88 | — | — | |
| SCHEMBL729660 | 0.88 | — | — | |
| SCHEMBL6906275 | 0.88 | — | — | |
| SCHEMBL21693722 | 0.88 | — | — | |
| SCHEMBL11310147 | 0.88 | — | — | |
| SCHEMBL3894540 | 0.88 | — | — |
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-5068375-A | Substituted noble metal xanthates | EXXON RESEARCH & ENGINEERING COMPANY (US) | 1991-11-26 | — | — | US | claimed |
| US-8435966-B2 | Associations of xanthogenates and cyclodextrins, and their use | BIOSPHINGS AG (DE) | 2013-05-07 | — | — | US | disclosed |
| US-20100240606-A1 | ASSOCIATIONS OF XANTHOGENATES AND CYCLODEXTRINS, AND THEIR USE | BIOSPHINGS AG (DE) | 2010-09-23 | — | — | US | disclosed |
| EP-2001840-A1 | ASSOCIATIONS OF XANTHOGENATES AND CYCLODEXTRINS, AND THEIR USE | BioSphings AG (DE) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007112828-A1 | ASSOCIATIONS OF XANTHOGENATES AND CYCLODEXTRINS, AND THEIR USE | BIOSPHINGS AG (DE) | 2007-10-11 | — | — | WO | disclosed |