⚠ 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 | |
|---|---|---|---|---|
| 1,2-Dichloroethane SCHEMBL10445508 | 0.86 | — | — | |
| 1,2-Dichloroethane SCHEMBL4584447 | 0.84 | — | — | |
| 1,2-Dichloroethane SCHEMBL6233635 | 0.84 | — | — | |
| 1,2-Dichloroethane SCHEMBL5324114 | 0.84 | — | — | |
| 1,2-Dichloroethane SCHEMBL127 | 0.84 | — | — | |
| 1,2-Dichloroethane SCHEMBL19182749 | 0.84 | TSHR (1.00) | — | |
| 1,2-Dichloroethane SCHEMBL504638 | 0.80 | — | — | |
| 1,2-Dichloroethane SCHEMBL1073614 | 0.80 | — | — | |
| 1,2-Dichloroethane SCHEMBL11661471 | 0.80 | — | — | |
| 1,2-Dichloroethane SCHEMBL5900065 | 0.80 | TSHR (0.62) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107935822-B | Preparation method of 1,2-di (2- (4-methoxyphenoxy) ethoxy) ethane | 西安近代化学研究所 | 2021-04-13 | — | — | CN | disclosed |
| EP-2940010-A1 | Ionic liquids based on oxalic acid mono amides | BASF SE (DE) | 2015-11-04 | — | — | EP | disclosed |
| US-20100029648-A1 | 11-Beta HSD1 Inhibitors | XIANG JASON SHAOYUN | 2010-02-04 | — | — | US | disclosed |
| US-7632838-B2 | 11-beta HSD1 inhibitors | WYETH (US) | 2009-12-15 | — | — | US | disclosed |
| EP-1981848-A2 | 11-BETA HSD1 INHIBITORS | Wyeth (US) | 2008-10-22 | — | — | EP | disclosed |
| US-20070219198-A1 | 11-Beta HSD 1 inhibitors | WYETH (US) | 2007-09-20 | — | — | US | disclosed |
| WO-2007092435-A2 | 11-BETA HSD1 INHIBITORS | WYETH (US) | 2007-08-16 | — | — | WO | disclosed |