⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3869767 | 1.00 | — | — | |
| SCHEMBL770651 | 0.81 | — | — | |
| SCHEMBL287484 | 0.81 | — | — | |
| SCHEMBL1218803 | 0.81 | — | — | |
| SCHEMBL770652 | 0.81 | — | — | |
| SCHEMBL1268718 | 0.81 | — | — | |
| SCHEMBL288917 | 0.81 | — | — | |
| SCHEMBL27597288 | 0.78 | — | — | |
| SCHEMBL29048413 | 0.75 | — | — | |
| Bicarbonate SCHEMBL11568925 | 0.70 | TSHR (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2104661-A1 | PROCESS FOR PREPARING 2-AMINOOXYETHANOL | Bayer CropScience AG (DE) | 2009-09-30 | — | — | EP | disclosed |
| WO-2008061616-A1 | PROCESS FOR PREPARING 2-AMINOOXYETHANOL | BAYER CROPSCIENCE AG (DE) | 2008-05-29 | — | — | WO | disclosed |
| EP-1925610-A1 | Production process of 2-aminooxyethanol | Bayer CropScience AG (DE) | 2008-05-28 | — | — | EP | disclosed |