⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27686656 | 0.97 | — | — | |
| Hydrogen Sulfide SCHEMBL16098395 | 0.94 | — | — | |
| Benzene SCHEMBL27809147 | 0.91 | — | — | |
| Hydrogen Sulfide SCHEMBL28004328 | 0.90 | — | — | |
| SCHEMBL4303682 | 0.90 | — | — | |
| SCHEMBL23039656 | 0.87 | — | — | |
| SCHEMBL5305550 | 0.87 | — | — | |
| SCHEMBL31072156 | 0.87 | — | — | |
| Iodide SCHEMBL8817348 | 0.87 | — | — | |
| SCHEMBL6368394 | 0.87 | — | — |
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-101477263-A | Display device | RUNGUANG SUN (CN) | 2009-07-08 | — | — | CN | disclosed |