⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27710433 | 0.85 | — | — | |
| SCHEMBL20207 | 0.85 | — | — | |
| SCHEMBL29186587 | 0.80 | — | — | |
| Methane SCHEMBL28458622 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL735264 | 0.80 | — | — | |
| Fluoride SCHEMBL23062667 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL20291761 | 0.80 | — | — | |
| SCHEMBL3145535 | 0.80 | — | — | |
| Fluoride SCHEMBL160907 | 0.80 | — | — | |
| SCHEMBL28776224 | 0.80 | — | — |
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-112811974-B | Novel aryl trifluoroethylene synthesized by arylation reagent and preparation method thereof | 中昊晨光化工研究院有限公司 | 2022-03-22 | — | — | CN | disclosed |
| CN-112624898-B | Synthetic method of aryl trifluoroethylene compound | 中昊晨光化工研究院有限公司 | 2022-03-22 | — | — | CN | disclosed |
| CN-112811974-A | Novel aryl trifluoroethylene synthesized by arylation reagent and preparation method thereof | 中昊晨光化工研究院有限公司 | 2021-05-18 | — | — | CN | disclosed |
| CN-112624898-A | Synthetic method of aryl trifluoroethylene compound | 中昊晨光化工研究院有限公司 | 2021-04-09 | — | — | CN | disclosed |
| CN-101390244-A | Liquid material for electrochemical cells | UNIV NORTH CAROLINA (US) | 2009-03-18 | — | — | CN | disclosed |