⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22787859 | 0.97 | — | — | |
| SCHEMBL22780496 | 0.96 | PDK2 (0.31) | — | |
| SCHEMBL22780302 | 0.96 | PDK2 (0.33) | — | |
| SCHEMBL23614151 | 0.94 | — | — | |
| SCHEMBL22780214 | 0.94 | PDK2 (0.32) | — | |
| SCHEMBL23614582 | 0.93 | — | — | |
| SCHEMBL22779999 | 0.93 | HSD11B1 (0.31) | — | |
| SCHEMBL22788040 | 0.93 | HSD11B1 (0.31) | — | |
| SCHEMBL22788006 | 0.93 | ESR1 (0.32) | — | |
| SCHEMBL22780008 | 0.93 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10985324-B2 | Nitrogen-containing compound, organic electroluminescent device and photoelectric conversion device | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2021-04-20 | — | — | US | disclosed |
| US-20200395544-A1 | Nitrogen-containing compound, organic electroluminescent device and photoelectric conversion device | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2020-12-17 | — | — | US | disclosed |
| WO-2020248755-A1 | NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND PHOTOELECTRIC CONVERSION DEVICE | 陕西莱特光电材料股份有限公司 | 2020-12-17 | — | — | WO | disclosed |
| EP-3750875-A2 | NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND PHOTOELECTRIC CONVERSION DEVICE | Shaanxi Lighte Optoelectronics Material Co., Ltd. (CN) | 2020-12-16 | — | — | EP | disclosed |