⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27805519 | 0.80 | — | — | |
| SCHEMBL17923336 | 0.72 | — | — | |
| SCHEMBL21925338 | 0.70 | — | — | |
| SCHEMBL598457 | 0.69 | MMP8 (0.32) | — | |
| SCHEMBL19851533 | 0.69 | — | — | |
| SCHEMBL1658596 | 0.69 | — | — | |
| SCHEMBL1784540 | 0.67 | — | — | |
| SCHEMBL16265456 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL14775391 | 0.67 | MEN1 (0.33) | — | |
| SCHEMBL21370322 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0451989-B1 | Etherification of gasoline | MOBIL OIL CORP (US) | 1994-08-10 | — | — | EP | disclosed |
| US-5080691-A | Hydration of olefins, etherification | MOBIL OIL CORP. (US) | 1992-01-14 | — | — | US | disclosed |
| US-5078751-A | High octane gasoline | MOBIL OIL CORPORATION (US) | 1992-01-07 | — | — | US | disclosed |
| EP-0454304-A1 | Process for the conversion of light olefins to ether-rich gasoline | MOBIL OIL CORPORATION (US) | 1991-10-30 | — | — | EP | disclosed |
| EP-0451989-A1 | Etherification of gasoline | MOBIL OIL CORPORATION (US) | 1991-10-16 | — | — | EP | disclosed |