⚠ 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 | |
|---|---|---|---|---|
| Oxirane SCHEMBL45627 | 0.84 | — | — | |
| Tetrahydrofuran SCHEMBL2041223 | 0.82 | — | — | |
| Methoxymethane SCHEMBL22118183 | 0.82 | — | — | |
| Dioxane SCHEMBL8962544 | 0.80 | — | — | |
| Methoxymethane SCHEMBL9829152 | 0.79 | — | — | |
| SCHEMBL8853906 | 0.78 | TSHR (1.00) | — | |
| SCHEMBL10380539 | 0.78 | TSHR (1.00) | — | |
| SCHEMBL975834 | 0.78 | — | — | |
| SCHEMBL27771 | 0.78 | — | — | |
| Fluoride SCHEMBL27757511 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102329411-B | Water/alcohol-soluble conjugated polymer material containing crosslinkable groups and application thereof | UNIV SOUTH CHINA TECH | 2013-07-03 | — | — | CN | disclosed |
| CN-102329411-A | Water/alcohol-soluble conjugated polymer material containing crosslinkable groups and application thereof | UNIV SOUTH CHINA TECH | 2012-01-25 | — | — | CN | disclosed |
| US-20090272290-A1 | Printing Ink | SERICOL LIMITED (GB) | 2009-11-05 | — | — | US | disclosed |
| CN-101090951-A | A printing ink | SERICOL LTD (GB) | 2007-12-19 | — | — | CN | disclosed |
| EP-1817384-A1 | A PRINTING INK | SERICOL LIMITED (GB) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006056781-A1 | A PRINTING INK | SERICOL LIMITED (GB) | 2006-06-01 | — | — | WO | disclosed |