⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23626247 | 0.97 | — | — | |
| SCHEMBL24604768 | 0.95 | — | — | |
| SCHEMBL24604765 | 0.95 | ALDH1A1 (0.30) | — | |
| SCHEMBL24604608 | 0.94 | — | — | |
| SCHEMBL24604855 | 0.94 | — | — | |
| SCHEMBL24604657 | 0.92 | — | — | |
| SCHEMBL24605280 | 0.91 | PIM3 (0.31) | — | |
| SCHEMBL24604764 | 0.91 | ALDH1A1 (0.30) | — | |
| SCHEMBL23618625 | 0.90 | — | — | |
| SCHEMBL23618617 | 0.90 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220216426-A1 | NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2022-07-07 | — | — | US | disclosed |
| WO-2021135182-A1 | NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS | 陕西莱特光电材料股份有限公司 | 2021-07-08 | — | — | WO | disclosed |