⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL14890285 | 0.82 | — | — | |
| SCHEMBL29610278 | 0.71 | — | — | |
| SCHEMBL32158 | 0.71 | — | — | |
| SCHEMBL114762 | 0.71 | — | — | |
| SCHEMBL11325053 | 0.71 | — | — | |
| SCHEMBL23528951 | 0.50 | — | — | |
| SCHEMBL1369291 | 0.50 | — | — | |
| SCHEMBL3421365 | 0.50 | — | — | |
| Hydrochloric Acid SCHEMBL20657074 | 0.50 | — | — | |
| Hydrochloric Acid SCHEMBL22285885 | 0.50 | — | — |
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-2777088-A1 | HYDROGEN GENERATOR | Intelligent Energy Ltd (GB) | 2014-09-17 | — | — | EP | disclosed |
| WO-2013070494-A1 | HYDROGEN GENERATOR | EVEREADY BATTERY COMPANY, INC. (US) | 2013-05-16 | — | — | WO | disclosed |