⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8333878 | 0.74 | — | — | |
| SCHEMBL9317684 | 0.74 | — | — | |
| SCHEMBL2876981 | 0.72 | — | — | |
| SCHEMBL4126338 | 0.71 | — | — | |
| SCHEMBL27875476 | 0.70 | — | — | |
| Fluoride SCHEMBL27833482 | 0.70 | — | — | |
| Iodide SCHEMBL28791586 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28125472 | 0.70 | — | — | |
| SCHEMBL9169523 | 0.69 | — | — | |
| SCHEMBL28069854 | 0.69 | — | — |
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-105294520-A | 2-(2 ', 2'-difluoro-ethoxy)-6-trifluoromethyl-phenylpropyl sulfur ether synthesis process | DALIAN JOIN KING BIOCHEM TECH CO LTD | 2016-02-03 | — | — | CN | claimed |
| CN-105294520-A | 2-(2 ', 2'-difluoro-ethoxy)-6-trifluoromethyl-phenylpropyl sulfur ether synthesis process | DALIAN JOIN KING BIOCHEM TECH CO LTD | 2016-02-03 | — | — | CN | disclosed |