⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22914823 | 1.00 | — | — | |
| SCHEMBL16099448 | 0.74 | — | — | |
| SCHEMBL6747100 | 0.74 | — | — | |
| SCHEMBL24406565 | 0.74 | — | — | |
| SCHEMBL20991844 | 0.72 | — | — | |
| SCHEMBL24449206 | 0.72 | — | — | |
| SCHEMBL24296390 | 0.70 | — | — | |
| SCHEMBL6751076 | 0.69 | — | — | |
| SCHEMBL22960820 | 0.69 | — | — | |
| SCHEMBL4566208 | 0.69 | SIGMAR1 (0.32) | — |
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-3922626-A1 | FLUORINE-CONTAINING ETHER COMPOUND, FLUORINE-CONTAINING ETHER COMPOSITION, COATING LIQUID, ARTICLE, METHOD FOR PRODUCING ARTICLE, AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND | AGC INC. (JP) | 2021-12-15 | — | — | EP | disclosed |