⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13984881 | 0.88 | MEN1 (0.51) | — | |
| SCHEMBL13448860 | 0.88 | MEN1 (0.51) | — | |
| SCHEMBL13984833 | 0.88 | MEN1 (0.51) | — | |
| SCHEMBL20405069 | 0.87 | — | — | |
| SCHEMBL15929798 | 0.87 | — | — | |
| SCHEMBL13448852 | 0.86 | NEU1 (0.36) | — | |
| SCHEMBL15933158 | 0.82 | — | — | |
| SCHEMBL17021517 | 0.82 | — | — | |
| SCHEMBL20404841 | 0.82 | — | — | |
| SCHEMBL3874111 | 0.81 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111793045-B | Oxabicyclo [4.1.0] heptane-1-carboxylic acid derivatives, their preparation, compositions and uses | 中山万远新药研发有限公司 | 2021-04-16 | — | — | CN | claimed |
| CN-111793045-A | Oxabicyclo [4.1.0] heptane-1-carboxylic acid derivatives, their preparation, compositions and uses | 中山万远新药研发有限公司 | 2020-10-20 | — | — | CN | claimed |
| CN-111517978-A | cyclohexenyl-DL-aspartic acid derivative, preparation method, composition and application thereof | 中山万汉制药有限公司 | 2020-08-11 | — | — | CN | claimed |
| CN-111470999-A | N-cyclohexenyl-fatty amide compound and preparation method, composition and application thereof | 中山万汉制药有限公司 | 2020-07-31 | — | — | CN | claimed |
| CN-111793045-B | Oxabicyclo [4.1.0] heptane-1-carboxylic acid derivatives, their preparation, compositions and uses | 中山万远新药研发有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-111793045-A | Oxabicyclo [4.1.0] heptane-1-carboxylic acid derivatives, their preparation, compositions and uses | 中山万远新药研发有限公司 | 2020-10-20 | — | — | CN | disclosed |
| CN-111517978-A | cyclohexenyl-DL-aspartic acid derivative, preparation method, composition and application thereof | 中山万汉制药有限公司 | 2020-08-11 | — | — | CN | disclosed |
| CN-111470999-A | N-cyclohexenyl-fatty amide compound and preparation method, composition and application thereof | 中山万汉制药有限公司 | 2020-07-31 | — | — | CN | disclosed |
| EP-2019818-B1 | PROCESS FOR THE PRODUCTION OF COMPOUNDS VIA HAZARDOUS INTERMEDIATES IN A SERIES OF MICROREACTORS | DPX HOLDINGS BV (NL) | 2020-03-18 | — | — | EP | disclosed |