⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29220096 | 0.83 | — | — | |
| SCHEMBL11185102 | 0.81 | — | — | |
| SCHEMBL8374145 | 0.80 | — | — | |
| SCHEMBL19111553 | 0.78 | — | — | |
| SCHEMBL1971857 | 0.76 | — | — | |
| SCHEMBL14107161 | 0.76 | — | — | |
| SCHEMBL27236928 | 0.76 | — | — | |
| SCHEMBL1998076 | 0.75 | — | — | |
| SCHEMBL9797158 | 0.75 | — | — | |
| SCHEMBL1324031 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115207481-A | Wide-temperature-range high-specific-energy lithium-carbon fluoride battery electrolyte and preparation method thereof | 南京信息工程大学 | 2022-10-18 | — | — | CN | claimed |
| US-20020198273-A1 | Isopropyl chloride with hydrofluorocarbon or hydrofluoroether as foam blowing agents | VULCAN CHEMICALS, DIVISION OF VULCAN MATERIALS COMPANY | 2002-12-26 | — | — | US | claimed |
| CN-115207481-A | Wide-temperature-range high-specific-energy lithium-carbon fluoride battery electrolyte and preparation method thereof | 南京信息工程大学 | 2022-10-18 | — | — | CN | disclosed |
| US-7393961-B2 | Polyhalogenated ethers | SOLVAY SOLEXIS S.P.A. (IT) | 2008-07-01 | — | — | US | disclosed |