⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24151987 | 0.92 | — | — | |
| SCHEMBL22505815 | 0.89 | — | — | |
| SCHEMBL23975230 | 0.88 | KDM4E (0.30) | — | |
| SCHEMBL24047421 | 0.88 | — | — | |
| SCHEMBL24047984 | 0.88 | NQO1 (0.31) | — | |
| SCHEMBL22506017 | 0.87 | GPR3 (0.38) | — | |
| SCHEMBL15852577 | 0.86 | — | — | |
| SCHEMBL22506047 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL22505830 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL23975169 | 0.86 | PTGDR2 (0.32) | — |
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-20210340103-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS THEREOF | DUK SAN NEOLUX CO., LTD (KR) | 2021-11-04 | — | — | US | disclosed |