⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL471842 | 0.75 | — | — | |
| SCHEMBL6841507 | 0.75 | — | — | |
| Bicarbonate SCHEMBL1080335 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL28264315 | 0.69 | ALDH1A1 (0.38) | — | |
| SCHEMBL5963573 | 0.69 | — | — | |
| SCHEMBL3367618 | 0.69 | — | — | |
| SCHEMBL5963576 | 0.69 | — | — | |
| SCHEMBL6215728 | 0.67 | — | — | |
| SCHEMBL28250963 | 0.67 | — | — | |
| Propene SCHEMBL28136799 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3266758-B1 | PRODUCTION METHOD FOR FLUORINE-CONTAINING OLEFIN COMPOUND | AGC INC (JP) | 2019-06-19 | — | — | EP | disclosed |