⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29699849 | 1.00 | — | — | |
| SCHEMBL1130031 | 0.98 | — | — | |
| Acrylic Acid SCHEMBL30096959 | 0.92 | LMNA (0.40) | — | |
| SCHEMBL21673010 | 0.71 | — | — | |
| SCHEMBL21888618 | 0.71 | — | — | |
| SCHEMBL18469805 | 0.71 | TGM2 (0.33) | — | |
| SCHEMBL29413825 | 0.69 | FBP1 (0.54) | — | |
| SCHEMBL22087937 | 0.68 | — | — | |
| SCHEMBL19867756 | 0.68 | — | — | |
| SCHEMBL13154418 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022135873-A1 | COMPONENT, ELECTROCHEMICAL CELL AND METHOD FOR PRODUCING A COMPONENT | ELRINGKLINGER AG (DE) | 2022-06-30 | — | — | WO | disclosed |