⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24802722 | 0.92 | NUDT1 (0.31) | — | |
| SCHEMBL24802720 | 0.92 | NUDT1 (0.31) | — | |
| SCHEMBL24801448 | 0.88 | NUDT1 (0.32) | — | |
| SCHEMBL24801473 | 0.88 | NUDT1 (0.32) | — | |
| SCHEMBL24801475 | 0.87 | NUDT1 (0.33) | — | |
| SCHEMBL24802768 | 0.85 | MEN1 (0.31) | — | |
| SCHEMBL24802233 | 0.83 | NUDT1 (0.34) | — | |
| SCHEMBL24804032 | 0.82 | NUDT1 (0.32) | — | |
| SCHEMBL23609990 | 0.82 | NUDT1 (0.36) | — | |
| SCHEMBL24802367 | 0.81 | NUDT1 (0.34) | — |
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-20220411411-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR PRODUCING ORGANIC LIGHT-EMITTING ELEMENT | LT MATERIALS CO.,LTD. (KR) | 2022-12-29 | — | — | US | disclosed |