⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL180404 | 0.82 | — | — | |
| SCHEMBL9618342 | 0.82 | — | — | |
| SCHEMBL1218867 | 0.82 | — | — | |
| SCHEMBL9418298 | 0.67 | — | — | |
| SCHEMBL15363607 | 0.67 | — | — | |
| SCHEMBL19714689 | 0.67 | — | — | |
| SCHEMBL5156248 | 0.67 | — | — | |
| Hydrogen Sulfide SCHEMBL21258142 | 0.67 | — | — | |
| SCHEMBL4311362 | 0.67 | — | — | |
| SCHEMBL31668855 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101140999-A | Direct carbon fuel battery | ZHIGANG ZHU (CN) | 2008-03-12 | — | — | CN | disclosed |