⚠ 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL945649 | 1.00 | ALDH1A1 (0.67) | — | |
| SCHEMBL126 | 0.82 | — | — | |
| SCHEMBL5438089 | 0.82 | — | — | |
| SCHEMBL11523834 | 0.82 | — | — | |
| SCHEMBL5728116 | 0.82 | — | — | |
| SCHEMBL3093207 | 0.78 | ALDH1A1 (0.53) | — | |
| Cyclohexane SCHEMBL29188796 | 0.77 | ALDH1A1 (0.50) | — | |
| Cyclopentane SCHEMBL20394153 | 0.76 | — | — | |
| Cyclohexane SCHEMBL457847 | 0.76 | LMNA (0.57) | — | |
| SCHEMBL22394670 | 0.76 | — | — |
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-109928862-B | Novel preparation method of alpha-vinylchloride cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-26 | — | — | CN | claimed |
| CN-109678652-B | Preparation method of ionic liquid promoted alpha, alpha-dichloroethyl cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-26 | — | — | CN | claimed |
| CN-109608303-B | Preparation method of high-purity alpha-vinylchloride cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-22 | — | — | CN | claimed |
| WO-2024146006-A1 | PREPARATION METHOD AND PURIFICATION METHOD FOR 2,2-DICHLOROPROPANE | 凯莱英生命科学技术(天津)有限公司 | 2024-07-11 | — | — | WO | disclosed |
| CN-109678651-B | Preparation method of high-purity alpha, alpha-dichloroethyl cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-11-12 | — | — | CN | disclosed |
| CN-109928862-B | Novel preparation method of alpha-vinylchloride cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-109678652-B | Preparation method of ionic liquid promoted alpha, alpha-dichloroethyl cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-109608303-B | Preparation method of high-purity alpha-vinylchloride cyclopropane | 瑞孚信江苏药业股份有限公司 | 2021-10-22 | — | — | CN | disclosed |