⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21084204 | 0.81 | — | — | |
| SCHEMBL6662772 | 0.79 | — | — | |
| SCHEMBL2827683 | 0.79 | — | — | |
| SCHEMBL11033825 | 0.75 | GAA (0.51) | — | |
| SCHEMBL22901899 | 0.75 | SMN1; SMN2 (0.53) | — | |
| SCHEMBL18912256 | 0.73 | KDM4E (0.47) | — | |
| SCHEMBL21083443 | 0.73 | NPC1 (0.50) | — | |
| SCHEMBL7522000 | 0.73 | NPC1 (0.50) | — | |
| SCHEMBL1664386 | 0.73 | — | — | |
| 4-Imidazolecarboxylic Acid SCHEMBL317725 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20190248729-A1 | STILBENE DERIVATIVE AND METHOD FOR PREPARING SAME | Ozchela Inc. (KR) | 2019-08-15 | — | — | US | disclosed |