⚠ 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 | |
|---|---|---|---|---|
| Methylsulfanylmethane SCHEMBL27732001 | 0.84 | — | — | |
| Ethane SCHEMBL27712091 | 0.76 | — | — | |
| Methyl Alcohol SCHEMBL27937131 | 0.76 | — | — | |
| SCHEMBL9547 | 0.74 | — | — | |
| SCHEMBL27513398 | 0.74 | CA1 (0.57) | — | |
| Water SCHEMBL9336807 | 0.74 | — | — | |
| SCHEMBL11560033 | 0.74 | — | — | |
| SCHEMBL27512693 | 0.74 | CA1 (0.57) | — | |
| Methylsulfanylmethane SCHEMBL3855929 | 0.74 | — | — | |
| Bromomethane SCHEMBL17223591 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-87102800-A | The coupled polyamine lubricant additives that makes with hydrocarbyl polynitriles and polyamines | — | 1987-10-28 | — | — | CN | claimed |
| CN-105940517-B | Organic solar cell and method for manufacturing same | 株式会社LG化学 | 2018-11-09 | — | — | CN | disclosed |