⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27608437 | 0.87 | — | — | |
| SCHEMBL7649701 | 0.87 | — | — | |
| SCHEMBL27544460 | 0.87 | — | — | |
| SCHEMBL31369275 | 0.75 | — | — | |
| SCHEMBL28564898 | 0.75 | — | — | |
| SCHEMBL27989010 | 0.75 | — | — | |
| SCHEMBL28847660 | 0.75 | — | — | |
| SCHEMBL7200364 | 0.75 | — | — | |
| SCHEMBL29190880 | 0.75 | — | — | |
| SCHEMBL28132959 | 0.75 | — | — |
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-116538424-A | Solid-state hydrogen storage device for room temperature | 上海中海龙智城科技股份有限公司 | 2023-08-04 | — | — | CN | disclosed |