⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13772912 | 0.71 | — | — | |
| SCHEMBL4622811 | 0.71 | — | — | |
| SCHEMBL4622031 | 0.58 | — | — | |
| SCHEMBL22853918 | 0.50 | ALOX5 (0.31) | — | |
| SCHEMBL22853917 | 0.50 | ALOX5 (0.31) | — | |
| SCHEMBL213006 | 0.48 | — | — | |
| SCHEMBL2404097 | 0.48 | — | — | |
| SCHEMBL707690 | 0.42 | — | — | |
| Cyclohexane SCHEMBL20699509 | 0.40 | LMNA (0.30) | — | |
| SCHEMBL302184 | 0.40 | — | — |
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-9447355-B2 | Fuel for compression-ignition engines based on monooxymethylene dimethylether | MAN TRUCK & BUS AG (DE) | 2016-09-20 | — | — | US | disclosed |
| US-20140223807-A1 | FUEL FOR COMPRESSION-IGNITION ENGINES BASED ON MONOOXYMETHYLENE DIMETHYLETHER | MAN TRUCK & BUS AG (DE) | 2014-08-14 | — | — | US | disclosed |