⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1965785 | 0.87 | — | — | |
| SCHEMBL3424166 | 0.85 | — | — | |
| SCHEMBL3249285 | 0.85 | — | — | |
| SCHEMBL9177587 | 0.85 | — | — | |
| SCHEMBL9483620 | 0.85 | — | — | |
| SCHEMBL3988090 | 0.85 | — | — | |
| SCHEMBL9568526 | 0.85 | — | — | |
| SCHEMBL9717670 | 0.85 | — | — | |
| SCHEMBL8827965 | 0.85 | — | — | |
| SCHEMBL24541537 | 0.84 | — | — |
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-3394023-B1 | METHODS FOR CONVERTING FLUORINATED COMPOUNDS | 3M INNOVATIVE PROPERTIES CO (US) | 2021-10-13 | — | — | EP | disclosed |