⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8776762 | 1.00 | — | — | |
| SCHEMBL1361286 | 0.78 | — | — | |
| SCHEMBL1361284 | 0.78 | — | — | |
| SCHEMBL3250928 | 0.78 | — | — | |
| SCHEMBL10489206 | 0.78 | — | — | |
| SCHEMBL11515972 | 0.76 | — | — | |
| SCHEMBL11348176 | 0.74 | — | — | |
| SCHEMBL11348174 | 0.74 | — | — | |
| SCHEMBL821097 | 0.74 | — | — | |
| SCHEMBL4379893 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808824-A2 | Process for preparing optically active 2-halogeno-3-hydroxypropionic acid ester | TANABE SEIYAKU CO., LTD. (JP) | 1997-11-26 | — | — | EP | disclosed |