⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL51456 | 0.80 | — | — | |
| Fluoride SCHEMBL28139161 | 0.76 | — | — | |
| SCHEMBL13716363 | 0.76 | — | — | |
| SCHEMBL88446 | 0.76 | — | — | |
| SCHEMBL28155935 | 0.74 | — | — | |
| Ethylene SCHEMBL8812428 | 0.72 | — | — | |
| SCHEMBL27180503 | 0.72 | — | — | |
| SCHEMBL27181501 | 0.72 | — | — | |
| SCHEMBL7733706 | 0.72 | — | — | |
| Iodide SCHEMBL28840362 | 0.71 | — | — |
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-104761446-A | Preparation method of 2-bromo-2,2-difluoroacetyl chloride and 2-bromo-2,2-difluoro acetate and recycling method of waste difluoro trichloroethane | JIANGXI SUNWAY CHEM CO LTD | 2015-07-08 | — | — | CN | disclosed |