⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16775 | 0.91 | — | — | |
| SCHEMBL194072 | 0.91 | — | — | |
| SCHEMBL4339911 | 0.86 | — | — | |
| Ethylene SCHEMBL11564128 | 0.86 | — | — | |
| SCHEMBL9096337 | 0.86 | — | — | |
| Methane SCHEMBL23281587 | 0.86 | — | — | |
| SCHEMBL8996012 | 0.86 | — | — | |
| SCHEMBL2196025 | 0.86 | — | — | |
| SCHEMBL1962965 | 0.86 | — | — | |
| Water SCHEMBL9852749 | 0.86 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0396086-B1 | Color toner | CANON KK (JP) | 1996-08-14 | — | — | EP | disclosed |
| US-5102761-A | Binder resin and xanthene dye solubilized in phenolic resin; clarity; nondeterioration of silicone rubber roll; environmental stability; photostability; offset resistance | CANON KABUSHIKI KAISHA (JP) | 1992-04-07 | — | — | US | disclosed |
| EP-0396086-A2 | Color toner | CANON KABUSHIKI KAISHA (JP) | 1990-11-07 | — | — | EP | disclosed |