⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24908179 | 1.00 | — | — | |
| SCHEMBL24767036 | 0.94 | PDK2 (0.30) | — | |
| SCHEMBL24908339 | 0.94 | PDK2 (0.30) | — | |
| SCHEMBL24479807 | 0.91 | HSP90AA1 (0.35) | — | |
| SCHEMBL21940946 | 0.89 | — | — | |
| SCHEMBL24908332 | 0.88 | — | — | |
| SCHEMBL24859902 | 0.88 | PGR (0.32) | — | |
| SCHEMBL24908338 | 0.87 | PRKDC (0.31) | — | |
| SCHEMBL24908189 | 0.87 | PRKDC (0.31) | — | |
| SCHEMBL24908430 | 0.86 | — | — |
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-20230020436-A1 | NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS | IDEMITSU KOSAN CO.,LTD. (JP) | 2023-01-19 | — | — | US | disclosed |