⚠ 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL104454 | 0.96 | — | — | |
| Trifluoroacetic Acid SCHEMBL496701 | 0.96 | — | — | |
| Trifluoroacetic Acid SCHEMBL8727023 | 0.92 | — | — | |
| Trifluoroacetic Acid SCHEMBL30657022 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL7814389 | 0.91 | ALDH1A1 (0.44) | — | |
| Trifluoroacetic Acid SCHEMBL4598430 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL474 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL2484766 | 0.91 | ALDH1A1 (0.44) | — | |
| Trifluoroacetic Acid SCHEMBL23043250 | 0.87 | ALDH1A1 (0.42) | — | |
| Trifluoroacetic Acid SCHEMBL22712611 | 0.87 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116315112-A | Perfluorinated electrolyte and secondary battery | 广州融捷能源科技有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-116315112-A | Perfluorinated electrolyte and secondary battery | 广州融捷能源科技有限公司 | 2023-06-23 | — | — | CN | disclosed |