⚠ 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 | |
|---|---|---|---|---|
| Isopropylamine SCHEMBL2802524 | 0.70 | — | — | |
| SCHEMBL1070026 | 0.64 | — | — | |
| SCHEMBL99231 | 0.64 | — | — | |
| SCHEMBL5005107 | 0.64 | — | — | |
| Lithium Ion SCHEMBL31512690 | 0.64 | — | — | |
| SCHEMBL305514 | 0.61 | — | — | |
| SCHEMBL7702357 | 0.61 | — | — | |
| SCHEMBL30731544 | 0.61 | — | — | |
| SCHEMBL7702370 | 0.61 | — | — | |
| SCHEMBL5224515 | 0.61 | — | — |
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-108273478-B | Formaldehyde removal composition and product | 李怀玉 | 2021-03-02 | — | — | CN | disclosed |