⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL627082 | 0.94 | — | — | |
| Bicarbonate SCHEMBL28131644 | 0.92 | KMT2A (0.50) | — | |
| Bicarbonate SCHEMBL28131645 | 0.92 | KMT2A (0.50) | — | |
| Methyl Alcohol SCHEMBL28209819 | 0.92 | — | — | |
| Hydrogen Sulfide SCHEMBL28165497 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL27881303 | 0.91 | — | — | |
| SCHEMBL28192711 | 0.91 | — | — | |
| Bromide SCHEMBL6429565 | 0.91 | — | — | |
| Water SCHEMBL27482734 | 0.91 | — | — | |
| SCHEMBL28256929 | 0.91 | — | — |
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-106283097-B | Cleaning liquid composition | 易安爱富科技有限公司 | 2018-12-04 | — | — | CN | disclosed |
| CN-106283097-A | Cleaning liquid composition | 易安爱富科技有限公司 | 2017-01-04 | — | — | CN | disclosed |