⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5312771 | 0.78 | — | — | |
| SCHEMBL6841949 | 0.78 | — | — | |
| Methyl Alcohol SCHEMBL27961453 | 0.75 | — | — | |
| SCHEMBL309945 | 0.73 | — | — | |
| SCHEMBL124324 | 0.73 | — | — | |
| SCHEMBL854551 | 0.71 | — | — | |
| SCHEMBL8979243 | 0.71 | — | — | |
| SCHEMBL1498050 | 0.71 | — | — | |
| Methylene Chloride SCHEMBL1774658 | 0.70 | — | — | |
| SCHEMBL2108706 | 0.70 | — | — |
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-105814649-A | Insulated cable | 株式会社自动网络技术研究所 | 2016-07-27 | — | — | CN | disclosed |