⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12866623 | 0.70 | NOS2 (0.33) | — | |
| SCHEMBL12091622 | 0.66 | — | — | |
| SCHEMBL2202874 | 0.63 | — | — | |
| SCHEMBL22047665 | 0.63 | — | — | |
| SCHEMBL19982751 | 0.62 | — | — | |
| SCHEMBL21233317 | 0.61 | — | — | |
| SCHEMBL1861441 | 0.61 | — | — | |
| SCHEMBL19982748 | 0.61 | — | — | |
| SCHEMBL14076167 | 0.61 | — | — | |
| SCHEMBL6845111 | 0.60 | — | — |
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-3512015-A1 | SLURRY COMPOSITION FOR MANUFACTURING ELECTRODE OF REDOX FLOW BATTERY AND METHOD FOR MANUFACTURING ELECTRODE OF REDOX FLOW BATTERY | Lotte Chemical Corporation (KR) | 2019-07-17 | — | — | EP | disclosed |