⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16366005 | 1.00 | — | — | |
| SCHEMBL798189 | 1.00 | — | — | |
| SCHEMBL7073737 | 1.00 | — | — | |
| SCHEMBL2168636 | 1.00 | — | — | |
| SCHEMBL15809714 | 1.00 | — | — | |
| SCHEMBL28742938 | 0.84 | — | — | |
| SCHEMBL24299777 | 0.81 | — | — | |
| SCHEMBL14543908 | 0.81 | — | — | |
| SCHEMBL13428769 | 0.81 | — | — | |
| SCHEMBL7654633 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2665721-A1 | METHYLTETRAZOLE SULFIDES AND SULFONES | DSM Sinochem Pharmaceuticals Netherlands B.V. (NL) | 2013-11-27 | — | — | EP | disclosed |
| EP-2665722-A1 | PROCESS FOR THE PREPARATION OF DIOL SULFONES | DSM Sinochem Pharmaceuticals Netherlands B.V. (NL) | 2013-11-27 | — | — | EP | disclosed |
| WO-2012098050-A1 | METHYLTETRAZOLE SULFIDES AND SULFONES | DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) | 2012-07-26 | — | — | WO | disclosed |
| WO-2012098048-A1 | PROCESS FOR THE PREPARATION OF DIOL SULFONES | DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) | 2012-07-26 | — | — | WO | disclosed |