⚠ 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL9377213 | 0.81 | TSHR (0.33) | — | |
| SCHEMBL10071804 | 0.81 | MEN1 (0.37) | — | |
| SCHEMBL13791889 | 0.79 | TSHR (0.53) | — | |
| SCHEMBL1682464 | 0.77 | — | — | |
| SCHEMBL1326296 | 0.74 | — | — | |
| SCHEMBL7688091 | 0.74 | — | — | |
| Di(Hydroxyethyl)Ether SCHEMBL27486796 | 0.73 | — | — | |
| SCHEMBL6434596 | 0.73 | — | — | |
| SCHEMBL12944181 | 0.72 | MEN1 (0.58) | — | |
| SCHEMBL766381 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108084326-A | The preparation of series adjustable composition polymer nanosphere from white light to primaries | 湖南科技大学 | 2018-05-29 | — | — | CN | claimed |
| EP-0380409-B1 | Process for the preparation of non-ionic surface-active agents from isopropylidene-1,2 epoxypropyl-3 glycerol and from hydroxylated compounds, non-ionic surface-active agents and use of same | OREAL (FR) | 1994-06-01 | — | — | EP | claimed |
| JP-54049322-A | — | — | None | — | — | JP | disclosed |
| CN-108084326-A | The preparation of series adjustable composition polymer nanosphere from white light to primaries | 湖南科技大学 | 2018-05-29 | — | — | CN | disclosed |
| CN-108084326-A | The preparation of series adjustable composition polymer nanosphere from white light to primaries | 湖南科技大学 | 2018-05-29 | — | — | CN | disclosed |
| JP-S5449322-A | NON-MEDICAL ANTI-BACTERIAL AND ANTI-MOLD AGENT | DAICEL CHEM IND LTD | 1979-04-18 | — | — | JP | disclosed |