⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL10580493 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL8979063 | 0.80 | — | — | |
| SCHEMBL28284883 | 0.80 | — | — | |
| SCHEMBL72567 | 0.78 | — | — | |
| SCHEMBL27987262 | 0.78 | — | — | |
| SCHEMBL15210074 | 0.78 | — | — | |
| SCHEMBL28268642 | 0.67 | — | — | |
| SCHEMBL28520148 | 0.67 | — | — | |
| SCHEMBL4294029 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL27541640 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0279096-B1 | BENZYL ETHER COMPOUND AND PROCESS FOR PRODUCING THE SAME | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1993-07-07 | — | — | EP | disclosed |
| EP-0279096-A2 | Benzyl ether compound and process for producing the same | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1988-08-24 | — | — | EP | disclosed |