⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8420239 | 0.87 | — | — | |
| SCHEMBL366639 | 0.82 | — | — | |
| SCHEMBL12382047 | 0.79 | — | — | |
| Methoxymethane SCHEMBL16109246 | 0.79 | — | — | |
| SCHEMBL1753464 | 0.75 | — | — | |
| SCHEMBL8670609 | 0.72 | — | — | |
| SCHEMBL14645572 | 0.70 | — | — | |
| SCHEMBL4145490 | 0.70 | — | — | |
| SCHEMBL6439135 | 0.70 | — | — | |
| SCHEMBL5200306 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0944568-A1 | METHOD OF PREPARING NONAFLUOROISOBUTYL METHYL ETHER | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1999-09-29 | — | — | EP | disclosed |
| WO-1998027041-A1 | METHOD OF PREPARING NONAFLUOROISOBUTYL METHYL ETHER | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-06-25 | — | — | WO | disclosed |
| US-5741950-A | FLUORINATING HEPTAFLUOROISOBUTENYL METHYL ETHER | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-04-21 | — | — | US | disclosed |