⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL51427 | 0.78 | — | — | |
| SCHEMBL776780 | 0.78 | — | — | |
| SCHEMBL1577017 | 0.74 | — | — | |
| SCHEMBL32997 | 0.74 | — | — | |
| SCHEMBL17865905 | 0.73 | — | — | |
| SCHEMBL2485763 | 0.73 | — | — | |
| SCHEMBL2485761 | 0.73 | — | — | |
| SCHEMBL5356112 | 0.72 | — | — | |
| SCHEMBL5356116 | 0.72 | — | — | |
| Water SCHEMBL20547670 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020026990-A1 | METHOD FOR PRODUCING PURIFIED FLUORINE-CONTAINING UNSATURATED HYDROCARBON | ＡＧＣ株式会社 | 2020-02-06 | — | — | WO | claimed |