⚠ 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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL1417372 | 1.00 | — | — | |
| Formic Acid SCHEMBL1687159 | 0.94 | — | — | |
| Formic Acid SCHEMBL28140359 | 0.94 | — | — | |
| Formic Acid SCHEMBL27901109 | 0.94 | — | — | |
| Formic Acid SCHEMBL27551950 | 0.94 | — | — | |
| Formic Acid SCHEMBL15260417 | 0.93 | ALDH1A1 (0.38) | — | |
| Formic Acid SCHEMBL1331809 | 0.93 | — | — | |
| Formic Acid SCHEMBL29399448 | 0.93 | — | — | |
| Formic Acid SCHEMBL6684167 | 0.93 | ALDH1A1 (0.38) | — | |
| Formic Acid SCHEMBL6682610 | 0.93 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105209645-B | The method that caesium or rubidium are collected from secondary ore | 卡博特公司 | 2017-10-31 | — | — | CN | disclosed |