⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13189607 | 0.82 | ALDH1A1 (0.36) | — | |
| SCHEMBL13189971 | 0.78 | LMNA (0.40) | — | |
| SCHEMBL16509668 | 0.74 | AOC3 (0.43) | — | |
| SCHEMBL13189766 | 0.69 | ALDH1A1 (0.44) | — | |
| SCHEMBL6435579 | 0.64 | ALDH1A1 (0.38) | — | |
| SCHEMBL9028094 | 0.63 | KDM4E (0.47) | — | |
| SCHEMBL16503537 | 0.63 | ABCB11 (0.35) | — | |
| SCHEMBL7152210 | 0.60 | AOC3 (0.49) | — | |
| SCHEMBL716226 | 0.58 | TPMT (0.48) | — | |
| Hydrogen Peroxide SCHEMBL11210753 | 0.58 | FABP3 (0.44) | — |
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-2403842-B1 | CHIRAL DISULFONIMIDES | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2016-06-29 | — | — | EP | disclosed |
| US-9079869-B2 | Chiral disulfonimides | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2015-07-14 | — | — | US | disclosed |
| US-20110313150-A1 | CHIRAL DISULFONIMIDES | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2011-12-22 | — | — | US | disclosed |
| WO-2010099786-A1 | CHIRAL DISULFONIMIDES | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2010-09-10 | — | — | WO | disclosed |