⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15635999 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL1062059 | 0.75 | — | — | |
| SCHEMBL22557962 | 0.74 | TSHR (0.37) | — | |
| SCHEMBL4023286 | 0.73 | — | — | |
| SCHEMBL1879791 | 0.70 | DRD2 (0.33) | — | |
| SCHEMBL8726034 | 0.69 | TSHR (0.42) | — | |
| SCHEMBL2648793 | 0.69 | — | — | |
| SCHEMBL16204756 | 0.67 | — | — | |
| SCHEMBL8676507 | 0.67 | — | — | |
| SCHEMBL14269405 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9783561-B2 | Chiral imidodiphosphates and derivatives thereof | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2017-10-10 | — | — | US | disclosed |
| 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-9079869-B2 | Chiral disulfonimides | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2015-07-14 | — | — | US | disclosed |
| US-20140350268-A1 | CHIRAL IMIDODIPHOSPHATES AND DERIVATIVES THEREOF | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2014-11-27 | — | — | US | disclosed |
| EP-2403842-A1 | CHIRAL DISULFONIMIDES | Studiengesellschaft Kohle MbH (DE) | 2012-01-11 | — | — | EP | disclosed |
| US-20110313150-A1 | CHIRAL DISULFONIMIDES | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 2011-12-22 | — | — | 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 |