⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21207271 | 0.94 | AKT1 (0.33) | — | |
| SCHEMBL26367399 | 0.88 | — | — | |
| SCHEMBL21207252 | 0.84 | MEN1 (0.38) | — | |
| SCHEMBL21038165 | 0.83 | — | — | |
| SCHEMBL26366101 | 0.82 | MEN1 (0.33) | — | |
| SCHEMBL26365755 | 0.79 | MEN1 (0.30) | — | |
| SCHEMBL26364619 | 0.78 | — | — | |
| SCHEMBL22161570 | 0.78 | — | — | |
| SCHEMBL20648543 | 0.78 | — | — | |
| SCHEMBL22815641 | 0.77 | ALDH1A1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3518303-A1 | N-(4-(8-(PHENYL)NAPHTHALEN-2-YL)PHENYL)-N,N'-DI(PHENYL)-AMINE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN ORGANIC ELECTROLUMINESCENCE DEVICES | Samsung Display Co., Ltd. (KR) | 2019-07-31 | — | — | EP | disclosed |