⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26021730 | 1.00 | — | — | |
| SCHEMBL23318690 | 0.97 | — | — | |
| SCHEMBL26021736 | 0.94 | — | — | |
| SCHEMBL23318833 | 0.94 | HSD17B1 (0.31) | — | |
| SCHEMBL23318751 | 0.94 | HSD17B1 (0.31) | — | |
| SCHEMBL26021724 | 0.93 | — | — | |
| SCHEMBL26021733 | 0.93 | — | — | |
| SCHEMBL23318652 | 0.92 | — | — | |
| SCHEMBL26021727 | 0.92 | — | — | |
| SCHEMBL23318686 | 0.92 | — | — |
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-2023140285-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2023-07-27 | — | — | WO | disclosed |