⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21906977 | 0.88 | — | — | |
| SCHEMBL24767121 | 0.88 | — | — | |
| SCHEMBL21655838 | 0.87 | — | — | |
| SCHEMBL16890759 | 0.86 | HDAC6 (0.34) | — | |
| SCHEMBL16890747 | 0.86 | HDAC6 (0.34) | — | |
| SCHEMBL23266902 | 0.86 | — | — | |
| SCHEMBL21710493 | 0.85 | — | — | |
| SCHEMBL24178294 | 0.85 | — | — | |
| SCHEMBL21710494 | 0.84 | — | — | |
| SCHEMBL22868340 | 0.84 | — | — |
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-20220393110-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION, POWDER, ELECTRONIC EQUIPMENT, AND NOVEL COMPOUND | IDEMITSU KOSAN CO.,LTD. (CN) | 2022-12-08 | — | — | US | disclosed |