⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4405078 | 0.78 | — | — | |
| SCHEMBL7049665 | 0.76 | — | — | |
| SCHEMBL11627705 | 0.76 | — | — | |
| SCHEMBL5672242 | 0.73 | — | — | |
| SCHEMBL5674947 | 0.73 | — | — | |
| SCHEMBL27782756 | 0.70 | ALDH1A1 (0.39) | — | |
| SCHEMBL22160893 | 0.70 | TSHR (0.38) | — | |
| SCHEMBL22491733 | 0.69 | — | — | |
| SCHEMBL14246414 | 0.69 | — | — | |
| SCHEMBL28143244 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106700476-A | Carbonic ester blended composition having improved environmental stress crack resistance | 盛禧奥欧洲有限责任公司 | 2017-05-24 | — | — | CN | disclosed |
| CN-103740074-B | There is the thermoplastic composition of impact resilience and anti-flammability | 拜尔材料科学有限公司 | 2016-10-05 | — | — | CN | disclosed |