⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL5604823 | 0.89 | FFAR3 (0.30) | — | |
| SCHEMBL9999342 | 0.76 | — | — | |
| SCHEMBL13909282 | 0.70 | — | — | |
| SCHEMBL51411 | 0.69 | — | — | |
| SCHEMBL11812602 | 0.69 | — | — | |
| SCHEMBL2173009 | 0.67 | — | — | |
| SCHEMBL28766218 | 0.67 | — | — | |
| SCHEMBL28833104 | 0.67 | ROCK2 (0.31) | — | |
| SCHEMBL6022856 | 0.67 | — | — | |
| SCHEMBL17183320 | 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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107001332-A | New piperidine derivative | 豪夫迈·罗氏有限公司 | 2017-08-01 | — | — | CN | claimed |
| CN-105594704-A | Bacteriostatic composition and application thereof in bacteriostatic laundry detergent | ZHONGSHAN CAREFORE DAILY PRODUCT CO LTD | 2016-05-25 | — | — | CN | claimed |
| CN-103788251-B | A kind of carrier for olefin polymerization catalyst and its preparation method and application | SINOPEC CORP. (CN) | 2016-05-25 | — | — | CN | claimed |
| CN-105585679-A | Cashew nut shell oil modified resorcin-aldehyde resin, and preparing method and applications thereof | SINO LEGEND (CHINA) CHEMICAL COMPANY LTD | 2016-05-18 | — | — | CN | claimed |
| CN-119219681-A | Method for synthesizing axial chiral organoboron compounds | 合成化学暨分子生物学有限公司 | 2024-12-31 | — | — | CN | disclosed |
| CN-118019742-A | Novel benzodiazepine derivatives as GABA Aγ1 PAM | 豪夫迈·罗氏有限公司 | 2024-05-10 | — | — | CN | disclosed |
| WO-2024030651-A1 | GPX4 INHIBITORS AND USE THEREOF | SONATA THERAPEUTICS, INC. (US) | 2024-02-08 | — | — | WO | disclosed |
| WO-2023169539-A1 | HYDROPHOBIC ANTI-REFLECTIVE GLASS FOR VEHICLE, FABRICATION METHOD THEREFOR, AND LAMINATED GLASS | 福耀玻璃工业集团股份有限公司 | 2023-09-14 | — | — | WO | disclosed |
| CN-116332937-A | Dipeptidyl peptidase I inhibitors and uses thereof | 杭州邦顺制药有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-115867277-A | Novel fused heterocyclyl-carbohydrazone acyldinitrile compounds and use thereof | 韩国科学技术研究院 | 2023-03-28 | — | — | CN | disclosed |
| WO-2022155815-A1 | BULK MOLDING COMPOUND AND LED DISPLAY SCREEN USING SAME | 惠州市艾比森光电有限公司 | 2022-07-28 | — | — | WO | disclosed |
| CN-114106005-A | Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof | 四川海思科制药有限公司 | 2022-03-01 | — | — | CN | disclosed |
| US-7279200-B2 | Comprises hex-5-enyl glyoxalate as photoinitiator; stable scratch-resistance; for use in paints, varnishes, powder coating, composites, and/or glass fiber cable coatings | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2007-10-09 | — | — | US | disclosed |
| US-20070197492-A1 | Modulation of Pathogenicity | QUONOVA, LLC | 2007-08-23 | — | — | US | disclosed |
| WO-2001004109-A1 | PROCESS FOR THE PRODUCTION OF 2-(2-PYRIDINYLMETHYLSULPHINYL)-1H-BENZIMIDAZOLES | QUIMICA SINTETICA, S.A. (ES) | 2001-01-18 | — | — | WO | disclosed |
| US-5877196-A | N- 4-(imidazolyl or pyrazolyl)phenyl(oxy, sulfinyl, sulfenyl or sulfonyl)alkyl!carboxamides, sulfonamides or phosphoramides having antiarrhythmic properties | AMERICAN CYANAMID COMPANY (US) | 1999-03-02 | — | — | US | disclosed |
| US-4139650-A | COLA BEVERAGE | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1979-02-13 | — | — | US | disclosed |
| US-4041084-A | 1,5-METHANO-INDEN-1-OLS; ORGANOLEPTIC MODIFIERS FOR FOODS, PERFUMES AND TOBACCO PRODUCTS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-08-09 | — | — | US | disclosed |
| US-4021494-A | CYCLOHEXADIENONE, ACETYLENIC COMPOUND; HYDROGENATION, CYCLIZATION | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-05-03 | — | — | US | disclosed |
| US-3996169-A | Perfume uses of tricyclic alcohols and processes | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1976-12-07 | — | — | US | disclosed |