⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8079423 | 0.69 | — | — | |
| SCHEMBL18173492 | 0.65 | — | — | |
| SCHEMBL7553490 | 0.61 | — | — | |
| SCHEMBL9550900 | 0.61 | — | — | |
| SCHEMBL8107400 | 0.46 | — | — | |
| SCHEMBL8973287 | 0.42 | — | — | |
| SCHEMBL17131854 | 0.41 | ALDH1A1 (0.31) | — | |
| SCHEMBL801296 | 0.41 | ALDH1A1 (0.31) | — | |
| SCHEMBL11841287 | 0.41 | — | — | |
| SCHEMBL10177686 | 0.40 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-218189662-U | 1,2-dibromoethane preparation device | 山东海王化工股份有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-218187975-U | 1, 2-dibromoethane apparatus for producing | 山东海王化工股份有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-115433054-A | Preparation method of 1, 2-dibromoethane | 山东海王化工股份有限公司 | 2022-12-06 | — | — | CN | disclosed |