⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25626756 | 0.92 | — | — | |
| SCHEMBL25618176 | 0.86 | — | — | |
| SCHEMBL25904379 | 0.86 | CNR2 (0.31) | — | |
| SCHEMBL25614643 | 0.83 | HSP90AA1 (0.30) | — | |
| SCHEMBL25614645 | 0.83 | ALOX5 (0.31) | — | |
| SCHEMBL25626218 | 0.83 | PDK2 (0.32) | — | |
| SCHEMBL25626010 | 0.81 | PDK2 (0.33) | — | |
| SCHEMBL25623911 | 0.81 | HSD11B1 (0.34) | — | |
| SCHEMBL25620856 | 0.81 | PDK2 (0.30) | — | |
| SCHEMBL25038114 | 0.80 | PDK2 (0.31) | — |
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-20230200215-A1 | ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2023-06-22 | — | — | US | disclosed |