⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL814883 | 0.82 | — | — | |
| SCHEMBL22829804 | 0.82 | — | — | |
| SCHEMBL8719571 | 0.82 | — | — | |
| SCHEMBL17505138 | 0.67 | — | — | |
| Arsenic SCHEMBL21750353 | 0.67 | — | — | |
| Iodide SCHEMBL7514711 | 0.67 | — | — | |
| SCHEMBL9661448 | 0.67 | — | — | |
| Iodide SCHEMBL21715093 | 0.67 | — | — | |
| Hydrogen Sulfide SCHEMBL14575897 | 0.67 | — | — | |
| Bromide SCHEMBL18441989 | 0.67 | — | — |
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-206793314-U | Adsorbed film of water deduster | 张子民 | 2017-12-26 | — | — | CN | disclosed |