⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL863158 | 0.77 | — | — | |
| SCHEMBL14022352 | 0.73 | — | — | |
| SCHEMBL21391742 | 0.73 | INMT (0.33) | — | |
| SCHEMBL4364151 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL26985849 | 0.71 | ADRB2 (0.38) | — | |
| SCHEMBL7810428 | 0.71 | — | — | |
| SCHEMBL12534004 | 0.70 | ALDH1A1 (0.37) | — | |
| SCHEMBL28134138 | 0.70 | — | — | |
| SCHEMBL28284219 | 0.69 | — | — | |
| SCHEMBL16280935 | 0.69 | INMT (0.30) | — |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109369533-A | The preparation method of 3- difluoromethyl -1- methvl-pyridinium -4- dicarbonyl chloride | 浙江本立科技股份有限公司 | 2019-02-22 | — | — | CN | claimed |
| CN-107033081-A | Formamide carbamide compounds of 3 difluoromethyl 1H pyrazoles of a kind of 1 methyl 4 and its preparation method and application | 浙江工业大学 | 2017-08-11 | — | — | CN | claimed |
| WO-2021057975-A1 | MUTANT IDH2 INHIBITOR AND APPLICATION THEREOF | 贝达药业股份有限公司 | 2021-04-01 | — | — | WO | disclosed |
| CN-109755647-A | A kind of magnesium battery electrolyte | 麻城市天力科技有限公司 | 2019-05-14 | — | — | CN | disclosed |
| US-20190092765-A1 | N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2019-03-28 | — | — | US | disclosed |
| CN-109476651-A | Kill the oxadiazole derivatives of microorganism | 先正达参股股份有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-109476614-A | Kill the oxadiazole derivatives of microorganism | 先正达参股股份有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-109476613-A | Microbicidal oxadiazole derivatives | 先正达参股股份有限公司 | 2019-03-15 | — | — | CN | disclosed |
| EP-2838893-B1 | N-CYCLOALKYL-N-[(HETEROCYCLYLPHENYL)METHYLENE]-(THIO)CARBOXAMIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2019-03-13 | — | — | EP | disclosed |
| CN-109311830-A | Kill the oxadiazole derivatives of microorganism | 先正达参股股份有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-109153657-A | Microbicidal oxadiazole derivatives | 先正达参股股份有限公司 | 2019-01-04 | — | — | CN | disclosed |
| CN-108289448-A | Kill microorganism oxadiazole derivatives | 先正达参股股份有限公司 | 2018-07-17 | — | — | CN | disclosed |
| CN-105452225-B | Cyclobutylmethyl amide compound as nematicide | 先正达参股股份有限公司 | 2018-07-06 | — | — | CN | disclosed |
| CN-108137570-A | Kill microorganism oxadiazole derivatives | 先正达参股股份有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-108137517-A | Kill microorganism oxadiazole derivatives | 先正达参股股份有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-107428722-A | Microbicidal heterobicyclic derivatives | 先正达参股股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-105218448-B | A kind of synthetic method of the pyrazole carboxylic acid of 1 methyl, 3 difluoromethyl 4 | 江苏恒润制药有限公司 | 2017-11-07 | — | — | CN | disclosed |
| CN-104114025-B | Nematicide cis (miscellaneous) aryl cyclopropyl carboxamides derivatives | 先正达参股股份有限公司 | 2017-11-07 | — | — | CN | disclosed |
| CN-106748814-A | As the N cyclic amides of nematicide | 先正达参股股份有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-104203916-B | N-cyclic amides as nematicides | 先正达参股股份有限公司 | 2017-05-03 | — | — | CN | disclosed |