⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7491125 | 0.93 | — | — | |
| SCHEMBL7490975 | 0.91 | — | — | |
| SCHEMBL7490307 | 0.91 | CTDSP1 (0.32) | — | |
| SCHEMBL22651958 | 0.84 | — | — | |
| SCHEMBL9044557 | 0.82 | — | — | |
| SCHEMBL5376368 | 0.82 | — | — | |
| SCHEMBL7488301 | 0.79 | — | — | |
| SCHEMBL8295518 | 0.75 | — | — | |
| SCHEMBL2919397 | 0.73 | — | — | |
| SCHEMBL5421843 | 0.71 | ALDH1A1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2443087-B1 | DISUBSTITUTED-AMINODIFLUOROSULFINIUM SALTS, PROCESS FOR PREPARING SAME AND METHOD OF USE AS DEOXOFLUORINATION REAGENTS | OMEGACHEM INC (CA) | 2016-06-08 | — | — | EP | disclosed |
| US-8680332-B2 | Disubstituted-aminodifluorosulfinium salts, process for preparing same and method of use as deoxofluorination reagents | OMEGACHEM INC. (CA) | 2014-03-25 | — | — | US | disclosed |
| US-20120108801-A1 | DISUBSTITUTED-AMINODIFLUOROSULFINIUM SALTS, PROCESS FOR PREPARING SAME AND METHOD OF USE AS DEOXOFLUORINATION REAGENTS | OMEGACHEM INC (CA) | 2012-05-03 | — | — | US | disclosed |
| EP-1201661-A1 | HETEROAROMATIC RING COMPOUNDS | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 2002-05-02 | — | — | EP | disclosed |
| EP-0735992-B1 | METHOD OF CONVERTING HYDROXYL GROUPS INTO CORRESPONDING FLUORO COMPOUNDS | BAYER AG (DE) | 2001-01-03 | — | — | EP | disclosed |