⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25805020 | 0.92 | MEN1 (0.30) | — | |
| SCHEMBL24886459 | 0.90 | CDC14B (0.34) | — | |
| SCHEMBL23597684 | 0.90 | — | — | |
| SCHEMBL24356205 | 0.89 | CDC14B (0.32) | — | |
| SCHEMBL23597118 | 0.88 | — | — | |
| SCHEMBL23285291 | 0.86 | — | — | |
| SCHEMBL24256747 | 0.86 | — | — | |
| SCHEMBL23597121 | 0.86 | P2RX7 (0.30) | — | |
| SCHEMBL23285313 | 0.86 | P2RX7 (0.30) | — | |
| SCHEMBL24256741 | 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 |
|---|---|---|---|---|---|---|---|
| EP-4201930-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING DEVICE | LT Materials Co., Ltd. (KR) | 2023-06-28 | — | — | EP | disclosed |