⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29093228 | 0.75 | — | — | |
| SCHEMBL28067376 | 0.73 | — | — | |
| SCHEMBL28007181 | 0.73 | — | — | |
| SCHEMBL14685518 | 0.72 | — | — | |
| SCHEMBL28123081 | 0.69 | — | — | |
| SCHEMBL27911997 | 0.68 | — | — | |
| SCHEMBL10145369 | 0.68 | — | — | |
| SCHEMBL28066380 | 0.65 | — | — | |
| SCHEMBL309674 | 0.64 | — | — | |
| SCHEMBL18903867 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104628585-B | A kind of diphenylamines or the preparation method of its nuclear substituted derivant | 山东道可化学有限公司 | 2016-08-24 | — | — | CN | disclosed |