⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1031834 | 0.75 | — | — | |
| SCHEMBL5206344 | 0.69 | — | — | |
| SCHEMBL664039 | 0.67 | — | — | |
| SCHEMBL9342 | 0.67 | — | — | |
| SCHEMBL82086 | 0.67 | — | — | |
| SCHEMBL1650668 | 0.65 | — | — | |
| SCHEMBL6989643 | 0.65 | — | — | |
| SCHEMBL20141641 | 0.65 | — | — | |
| SCHEMBL20141352 | 0.65 | — | — | |
| SCHEMBL11507788 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-4112862-B2 | — | — | 2008-07-02 | — | — | JP | claimed |
| EP-1268381-A4 | PRODUCTION OF FLUORMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL)ETHYL ETHER | HALOCARBON PROD CORP (US) | 2004-10-20 | — | — | EP | claimed |
| JP-2003530323-A | — | — | 2003-10-14 | — | — | JP | claimed |
| EP-1268381-A1 | PRODUCTION OF FLUORMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL)ETHYL ETHER | Halocarbon Products Corporation (US) | 2003-01-02 | — | — | EP | claimed |
| WO-2001068577-A1 | PRODUCTION OF FLUORMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL)ETHYL ETHER | HALOCARBON PRODUCTS CORPORATION (US) | 2001-09-20 | — | — | WO | claimed |