⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18285183 | 0.84 | — | — | |
| SCHEMBL2729904 | 0.84 | — | — | |
| SCHEMBL180483 | 0.81 | CDC25A (0.31) | — | |
| SCHEMBL18285267 | 0.70 | — | — | |
| SCHEMBL18285269 | 0.70 | — | — | |
| SCHEMBL18285122 | 0.70 | — | — | |
| SCHEMBL29174076 | 0.69 | — | — | |
| SCHEMBL18285209 | 0.68 | — | — | |
| SCHEMBL18285192 | 0.66 | — | — | |
| SCHEMBL18285191 | 0.66 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116940466-A | Consumer products | 联合利华知识产权控股有限公司 | 2023-10-24 | — | — | CN | disclosed |
| CN-116509735-A | Fragrance and flavor compositions containing acetophenone derivatives | 西姆莱斯股份公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-116249510-A | Cyclopropanated sandalwood type compounds | 西姆莱斯股份公司 | 2023-06-09 | — | — | CN | disclosed |
| CN-112567013-B | Benefit agent delivery particles | 联合利华知识产权控股有限公司 | 2023-05-26 | — | — | CN | disclosed |
| CN-115997003-A | Irritation-reducing surfactants | 联合利华知识产权控股有限公司 | 2023-04-21 | — | — | CN | disclosed |
| CN-109311789-B | Process for preparing 2, 3-unsaturated alcohols | 巴斯夫欧洲公司 | 2023-04-04 | — | — | CN | disclosed |