⚠ 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 | |
|---|---|---|---|---|
| Chloromethane SCHEMBL4098077 | 0.78 | — | — | |
| Ethane SCHEMBL27695716 | 0.78 | — | — | |
| Ethane SCHEMBL218028 | 0.78 | — | — | |
| SCHEMBL27986358 | 0.78 | CA5A (0.33) | — | |
| SCHEMBL6681816 | 0.78 | — | — | |
| SCHEMBL254 | 0.78 | — | — | |
| SCHEMBL9540531 | 0.78 | — | — | |
| SCHEMBL573159 | 0.76 | — | — | |
| SCHEMBL28931568 | 0.76 | ALDH1A1 (0.30) | — | |
| Dimethyl Sulfone SCHEMBL15941152 | 0.74 | KDM4E (0.67) | — |
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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110668952-B | Preparation method of benzphetamine hydrochloride | 安徽贝克制药股份有限公司 | 2023-06-27 | — | — | CN | claimed |
| CN-110642721-B | Preparation method of selegiline hydrochloride | 安徽贝克生物制药有限公司 | 2022-09-30 | — | — | CN | claimed |
| CN-110668952-A | Preparation method of benzphetamine hydrochloride | 安徽贝克联合制药有限公司 | 2020-01-10 | — | — | CN | claimed |
| CN-110642721-A | Preparation method of selegiline hydrochloride | 安徽贝克生物制药有限公司 | 2020-01-03 | — | — | CN | claimed |
| CN-111919326-B | Electrolyte, electrochemical device, lithium ion secondary battery, assembly, and compound | 大金工业株式会社 | 2024-06-11 | — | — | CN | disclosed |
| CN-112778183-B | Nitrogen-containing ring derivative regulator, preparation method and application thereof | 江苏豪森药业集团有限公司 | 2024-05-10 | — | — | CN | disclosed |
| CN-110325534-B | Substituted imidazoquinolines as NLRP3 modulators | 先天肿瘤免疫公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-110668952-B | Preparation method of benzphetamine hydrochloride | 安徽贝克制药股份有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-113831302-B | Benzisoselenazolone derivative and preparation method and application thereof | 山东大学 | 2022-11-29 | — | — | CN | disclosed |
| CN-115209952-A | Substituted pyrazolopyrimidines and use thereof | 维基分析有限公司 | 2022-10-18 | — | — | CN | disclosed |
| CN-110642721-B | Preparation method of selegiline hydrochloride | 安徽贝克生物制药有限公司 | 2022-09-30 | — | — | CN | disclosed |
| CN-114728909-A | Composition for preventing or treating cancer comprising novel trifluoromethylphenylpyrazole derivative as active ingredient | 韩国原子力医学院 | 2022-07-08 | — | — | CN | disclosed |
| CN-101896482-B | Thiophene derivatives as S1P1/EDG1 agonists | ACTELION PHARMACEUTICALS LTD | 2013-01-09 | — | — | CN | disclosed |
| CN-101896482-A | Thiophene derivatives as S1P1/EDG1 agonists | ACTELION PHARMACEUTICALS LTD | 2010-11-24 | — | — | CN | disclosed |
| CN-1950376-B | Curcumol derivatives, compositions comprising the same and use in manufacture of medicament | Hangzhou minsheng pharmaceutical group co ltd | 2010-09-08 | — | — | CN | disclosed |
| US-7700584-B2 | antitumor agents; viricides | HANGZHOU MINSHENG PHARMACEUTICALS CO., LTD. (CN) | 2010-04-20 | — | — | US | disclosed |
| US-20070191360-A1 | antitumor agents; viricides | HANGZHOU MINSHENG PHARMACEUTICALS CO., LTD. (CN) | 2007-08-16 | — | — | US | disclosed |
| EP-1749830-A1 | CURCUMOL DERIVATIVES, THE COMPOSITIONS COMPRISING THE SAME AND THE USE OF THE SAME IN THE MANUFACTURE OF MEDICAMENT | Hangzhou Minsheng Pharmaceuticals Co., Ltd. (CN) | 2007-02-07 | — | — | EP | disclosed |
| WO-2005013995-A1 | 4-SUBSTITUTED 7-ALKOXY-2-AMINOSULFONYL-1,2-DIHYDRO-PHTALAZIN DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS FOR THE TREATMENT OF ALLERGIES AND INFLAMMATIONS | ZAMBON GROUP S.P.A. (IT) | 2005-02-17 | — | — | WO | disclosed |
| EP-0148725-A1 | Sulfonamido-benzamide derivatives | SHIONOGI & CO., LTD. (JP) | 1985-07-17 | — | — | EP | disclosed |