⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29350699 | 0.97 | — | — | |
| SCHEMBL11735289 | 0.97 | ACHE (0.71) | — | |
| SCHEMBL11789 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL2551919 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL7913171 | 0.94 | ACHE (0.67) | — | |
| Methane SCHEMBL6682100 | 0.94 | — | — | |
| Water SCHEMBL8601211 | 0.94 | — | — | |
| Methylamine SCHEMBL11826976 | 0.94 | ACHE (0.67) | — | |
| SCHEMBL22719995 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL2477661 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0027003-B1 | A PROCESS FOR PREPARING A DIARYLAMINE | XEROX CORPORATION (US) | 1983-06-29 | — | — | EP | disclosed |
| EP-0027003-A1 | A process for preparing a diarylamine | XEROX CORPORATION (US) | 1981-04-15 | — | — | EP | disclosed |