⚠ 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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL27935679 | 0.96 | TSHR (0.93) | — | |
| Methylene Chloride SCHEMBL27908064 | 0.96 | TSHR (0.93) | — | |
| SCHEMBL3164 | 0.96 | — | — | |
| Hexane SCHEMBL8845002 | 0.96 | TSHR (0.92) | — | |
| SCHEMBL276808 | 0.96 | — | — | |
| SCHEMBL9285670 | 0.96 | TSHR (0.92) | — | |
| SCHEMBL5575281 | 0.92 | TSHR (1.00) | — | |
| SCHEMBL11742005 | 0.92 | TSHR (1.00) | — | |
| Fluoride SCHEMBL21873339 | 0.92 | — | — | |
| SCHEMBL22186971 | 0.92 | TSHR (1.00) | — |
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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104910188-B | A kind of synthetic method of Cefazolin acid | 齐鲁安替制药有限公司 | 2017-07-04 | — | — | CN | claimed |
| CN-104557756-B | Synthetic method of parecoxib sodium impurity | 成都克莱蒙医药科技有限公司 | 2017-02-22 | — | — | CN | claimed |
| CN-104356027-A | Preparation method of N-alkoxy substituted amide | SINOPHARM CHEMICAL REAGENT CO LTD | 2015-02-18 | — | — | CN | claimed |
| CN-115414357-B | Application of amide compound in preparation of medicaments for preventing and treating myopia | 天津医科大学眼科医院 | 2023-09-22 | — | — | CN | disclosed |
| US-20230227415-A1 | TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF | SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) | 2023-07-20 | — | — | US | disclosed |
| CN-114479391-B | Preparation method of graphene oxide/bisphenol-A type polyarylate composite material | 安徽理工大学 | 2023-06-23 | — | — | CN | disclosed |
| EP-4169910-A1 | TRIAZINE BENZOATE COMPOUND AND APPLICATION THEREOF | Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) | 2023-04-26 | — | — | EP | disclosed |
| CN-115181069-B | Compound for preventing and treating myopia | 天津医科大学眼科医院 | 2023-04-11 | — | — | CN | disclosed |
| CN-115414357-A | Application of amide compound in preparation of medicine for preventing and treating myopia | 天津医科大学眼科医院 | 2022-12-02 | — | — | CN | disclosed |
| CN-115181069-A | Compound for preventing and treating myopia | 天津医科大学眼科医院 | 2022-10-14 | — | — | CN | disclosed |
| CN-114479391-A | Preparation method of graphene oxide/bisphenol-A polyarylate composite material | 安徽理工大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-1821236-A | Therapeutic heterocyclic compounds | ASTRAZENECA AB (SE) | 2006-08-23 | — | — | CN | disclosed |
| CN-1242993-C | Heterocycle derivatives and drugs | NIPPON SHINYAKU CO LTD (JP) | 2006-02-22 | — | — | CN | disclosed |
| CN-1527827-A | Therapeutic heterocyclic compounds | — | 2004-09-08 | — | — | CN | disclosed |
| CN-1156476-C | 1-cycloalkyl-1, 8-naphthyridin-4-one derivatives as phosphodiesterase type IV inhibitors | ��һ��������ҩ��ʽ���� | 2004-07-07 | — | — | CN | disclosed |
| CN-1149082-C | Di-and trivalent small molecule selecting protein inhibitors | �ÿ���˹���＼����˾ | 2004-05-12 | — | — | CN | disclosed |
| CN-1422255-A | Heterocycle derivatives and drugs | NIPPON SHINYAKU CO LTD (JP) | 2003-06-04 | — | — | CN | disclosed |
| CN-1256693-A | 1-cycloalkyl-1,8-naphthyridin-4-one derivatives with phosphodiesterase IV inhibitory activity | SUNTORY LTD (JP) | 2000-06-14 | — | — | CN | disclosed |
| CN-1196678-A | Di-and trivalent small molecule selecting protein inhibitors | TEXAS BIOTECHANOLOGY CORP (US) | 1998-10-21 | — | — | CN | disclosed |
| CN-1177356-A | Bicyclic benzazepine derivatives as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-03-25 | — | — | CN | disclosed |