⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25943 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28800370 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL28452517 | 0.89 | — | — | |
| SCHEMBL9001301 | 0.89 | — | — | |
| Hydrogen Sulfide SCHEMBL8192404 | 0.89 | — | — | |
| Water SCHEMBL28322354 | 0.89 | — | — | |
| Methane SCHEMBL29065900 | 0.84 | — | — | |
| Iodide SCHEMBL29203647 | 0.84 | — | — | |
| Bromide SCHEMBL29203645 | 0.84 | — | — | |
| Hydrazine SCHEMBL11731282 | 0.84 | — | — |
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-106631679-B | Produce the improvement technique of the chloro- 1.2.2- trifluoroethane of 1.1.2- tri- | 浙江埃克盛化工有限公司 | 2019-11-19 | — | — | CN | claimed |
| CN-106631679-B | Produce the improvement technique of the chloro- 1.2.2- trifluoroethane of 1.1.2- tri- | 浙江埃克盛化工有限公司 | 2019-11-19 | — | — | CN | disclosed |