⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL237 | 0.87 | — | — | |
| SCHEMBL30536993 | 0.87 | — | — | |
| SCHEMBL175558 | 0.87 | — | — | |
| SCHEMBL30788722 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL23420518 | 0.80 | — | — | |
| Fluoride SCHEMBL780440 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL1473454 | 0.80 | — | — | |
| SCHEMBL8749498 | 0.80 | — | — | |
| Hydrogen Sulfide SCHEMBL21359612 | 0.80 | — | — | |
| Fluoride SCHEMBL11215445 | 0.80 | TSHR (0.39) | — |
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-208932994-U | A kind of separator for separation phosgene in purification media | 欧中电子材料（重庆）有限公司 | 2019-06-04 | — | — | CN | disclosed |