⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7227356 | 0.75 | — | — | |
| SCHEMBL68724 | 0.75 | TSHR (0.44) | — | |
| Nitroacetic Acid SCHEMBL953175 | 0.74 | LMNA (0.46) | — | |
| Nitroacetic Acid SCHEMBL16673169 | 0.74 | LMNA (0.46) | — | |
| SCHEMBL2441916 | 0.73 | — | — | |
| SCHEMBL7228408 | 0.73 | — | — | |
| Nitroacetic Acid SCHEMBL28647899 | 0.72 | LMNA (0.44) | — | |
| Nitroacetic Acid SCHEMBL28647373 | 0.72 | LMNA (0.44) | — | |
| Nitroacetic Acid SCHEMBL7784649 | 0.72 | LMNA (0.44) | — | |
| Nitroacetic Acid SCHEMBL2263714 | 0.72 | LMNA (0.44) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111433930-A | Arylamine compound and organic electroluminescent element | 保土谷化学工业株式会社 | 2020-07-17 | — | — | CN | disclosed |
| US-8629613-B2 | Aromatic amine derivative and organic electroluminescent device using same | IDEMITSU KOSAN CO., LTD. (JP) | 2014-01-14 | — | — | US | disclosed |
| US-20080108811-A1 | Aromatic Amine Derivative and Organic Electroluminescent Device Using Same | IDEMITSU KOSAN CO., LTD. (JP) | 2008-05-08 | — | — | US | disclosed |