⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30434679 | 0.85 | — | — | |
| SCHEMBL6033245 | 0.83 | — | — | |
| SCHEMBL8641998 | 0.79 | — | — | |
| SCHEMBL9011870 | 0.76 | — | — | |
| SCHEMBL30801356 | 0.76 | — | — | |
| SCHEMBL29638849 | 0.76 | — | — | |
| SCHEMBL8640382 | 0.74 | — | — | |
| SCHEMBL29889070 | 0.74 | — | — | |
| SCHEMBL29693701 | 0.73 | — | — | |
| SCHEMBL11753286 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115746013-A | Preparation method and application of benzo-heterocycle dianhydride derivatives | 南京大学 | 2023-03-07 | — | — | CN | claimed |
| CN-114806651-B | Modified alcohol-based composite environment-friendly fuel | 陈记 | 2023-07-14 | — | — | CN | disclosed |
| CN-114806650-B | Low-proportion methanol gasoline for vehicle | 陈记 | 2023-07-14 | — | — | CN | disclosed |
| CN-115746013-A | Preparation method and application of benzo-heterocycle dianhydride derivatives | 南京大学 | 2023-03-07 | — | — | CN | disclosed |
| CN-115232137-A | Compound having diaza dibenzofuran or diaza dibenzothiophene structure | 默克专利有限公司 | 2022-10-25 | — | — | CN | disclosed |
| CN-115160328-A | Compounds having a structure of diaza-dibenzofuran or diaza-dibenzothiophene | 默克专利有限公司 | 2022-10-11 | — | — | CN | disclosed |
| CN-114806651-A | Modified alcohol-based composite environment-friendly fuel | 陈记 | 2022-07-29 | — | — | CN | disclosed |
| CN-114806650-A | Low-proportion methanol gasoline for vehicles | 陈记 | 2022-07-29 | — | — | CN | disclosed |