⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31415116 | 0.72 | — | — | |
| SCHEMBL6428253 | 0.72 | — | — | |
| SCHEMBL4411735 | 0.71 | — | — | |
| SCHEMBL9843108 | 0.71 | — | — | |
| SCHEMBL18598932 | 0.71 | — | — | |
| SCHEMBL2231256 | 0.71 | — | — | |
| SCHEMBL2930784 | 0.71 | — | — | |
| SCHEMBL29135326 | 0.69 | — | — | |
| SCHEMBL6550478 | 0.69 | — | — | |
| SCHEMBL1318886 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7754406-B2 | Ultra low melt emulsion aggregation toners having a charge control agent | XEROX CORPORATION (US) | 2010-07-13 | — | — | US | disclosed |
| US-20080193869-A1 | ULTRA LOW MELT EMULSION AGGREGATION TONERS HAVING A CHARGE CONTROL AGENT | XEROX CORPORATION (US) | 2008-08-14 | — | — | US | disclosed |