⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28909722 | 0.94 | — | — | |
| Fluoromethane SCHEMBL28141227 | 0.88 | — | — | |
| SCHEMBL27370753 | 0.80 | — | — | |
| Ethylenediamine SCHEMBL28056173 | 0.76 | — | — | |
| SCHEMBL23044067 | 0.76 | — | — | |
| SCHEMBL29859818 | 0.76 | — | — | |
| SCHEMBL8539535 | 0.76 | — | — | |
| SCHEMBL1357 | 0.76 | — | — | |
| SCHEMBL2339 | 0.76 | — | — | |
| SCHEMBL14722063 | 0.76 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118251475-A | Azeotropic and azeotrope-like compositions of perfluoroheptenes and fluoroethers and uses thereof | 科慕埃弗西有限公司 | 2024-06-25 | — | — | CN | claimed |
| CN-114340753-B | Method for purifying hydrofluorocarbons | 阿科玛法国公司 | 2023-10-20 | — | — | CN | claimed |
| CN-118056001-A | Ternary azeotrope and azeotrope-like compositions for solvent and cleaning applications | 科慕埃弗西有限公司 | 2024-05-17 | — | — | CN | disclosed |
| CN-114340753-B | Method for purifying hydrofluorocarbons | 阿科玛法国公司 | 2023-10-20 | — | — | CN | disclosed |
| US-20110184187-A1 | PROCESS FOR THE PREPARATION OF TETRAZOLE DERIVATIVES FROM ORGANO BORON AND ORGANO ALUMINIUM AZIDES | SEDELMEIER GOTTFRIED | 2011-07-28 | — | — | US | disclosed |