⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2488615 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL30504271 | 0.74 | — | — | |
| SCHEMBL30504292 | 0.74 | — | — | |
| SCHEMBL28512331 | 0.74 | — | — | |
| SCHEMBL2490289 | 0.74 | — | — | |
| SCHEMBL27800759 | 0.70 | — | — | |
| SCHEMBL27567160 | 0.65 | — | — | |
| SCHEMBL9572885 | 0.61 | — | — | |
| SCHEMBL126608 | 0.60 | — | — | |
| SCHEMBL30629015 | 0.60 | — | — |
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-116751183-A | Hexamethyl octahydrogen bridge methylene chamomile and dioxole | 奇华顿股份有限公司 | 2023-09-15 | — | — | CN | disclosed |
| CN-111689940-A | Hexamethyloctahydro bridged methyleneazulene dioxoles | 奇华顿股份有限公司 | 2020-09-22 | — | — | CN | disclosed |
| CN-111689940-A | Hexamethyloctahydro bridged methyleneazulene dioxoles | 奇华顿股份有限公司 | 2020-09-22 | — | — | CN | disclosed |
| CN-102781901-B | For the method preparing monomer component from genetically modified polyhydroxyalkanoatefrom biomass | 梅塔玻利克斯公司 | 2016-08-03 | — | — | CN | disclosed |
| CN-105579563-A | Lubricating oil composition for traction transmission | IDEMITSU KOSAN CO | 2016-05-11 | — | — | CN | disclosed |
| CN-102470092-A | Melanin production inhibitor | FANCL CORP | 2012-05-23 | — | — | CN | disclosed |