⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20168 | 0.97 | — | — | |
| SCHEMBL28132514 | 0.97 | — | — | |
| SCHEMBL25397062 | 0.95 | — | — | |
| Methane SCHEMBL5484517 | 0.95 | — | — | |
| Ethane SCHEMBL28170087 | 0.95 | — | — | |
| Methane SCHEMBL251799 | 0.95 | — | — | |
| SCHEMBL2229944 | 0.95 | — | — | |
| SCHEMBL27650623 | 0.95 | — | — | |
| SCHEMBL22462258 | 0.95 | — | — | |
| SCHEMBL28226535 | 0.95 | — | — |
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-105849213-A | Moisture curable compositions | 道康宁公司 | 2016-08-10 | — | — | CN | disclosed |