⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1473 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7991143 | 0.94 | — | — | |
| Ethane SCHEMBL21448368 | 0.94 | — | — | |
| SCHEMBL16005479 | 0.94 | — | — | |
| Methoxymethane SCHEMBL10489227 | 0.94 | — | — | |
| SCHEMBL1961580 | 0.94 | — | — | |
| Water SCHEMBL10401883 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL3448421 | 0.94 | — | — | |
| Water SCHEMBL5512954 | 0.94 | — | — | |
| SCHEMBL27883502 | 0.94 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103896746-A | Method for preparing ethyl methyl ether by adopting reaction of sodium alkoxide and alkyl halide | TIANJIN TAIHENG GASES CO LTD | 2014-07-02 | — | — | CN | disclosed |