⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29706046 | 1.00 | — | — | |
| SCHEMBL24227115 | 0.92 | — | — | |
| SCHEMBL29706020 | 0.91 | PGR (0.33) | — | |
| SCHEMBL20208906 | 0.91 | PGR (0.33) | — | |
| SCHEMBL20208904 | 0.89 | PDK2 (0.33) | — | |
| SCHEMBL26444920 | 0.89 | PDK2 (0.33) | — | |
| SCHEMBL25561269 | 0.86 | PDK2 (0.31) | — | |
| SCHEMBL29706008 | 0.82 | PDK2 (0.31) | — | |
| SCHEMBL20208905 | 0.82 | PDK2 (0.31) | — | |
| SCHEMBL19533771 | 0.80 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11239426-B2 | Electroactive compounds | LG CHEM, LTD. | 2022-02-01 | — | — | US | disclosed |
| WO-2018097937-A1 | ELECTROACTIVE COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2018-05-31 | — | — | WO | disclosed |