⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16704320 | 0.97 | ALDH1A1 (0.30) | — | |
| SCHEMBL1541022 | 0.97 | ALDH1A1 (0.30) | — | |
| SCHEMBL1541935 | 0.97 | ALDH1A1 (0.30) | — | |
| SCHEMBL1541932 | 0.97 | ALDH1A1 (0.30) | — | |
| SCHEMBL1542072 | 0.94 | — | — | |
| SCHEMBL3380327 | 0.78 | TRIM24 (0.35) | — | |
| SCHEMBL16168100 | 0.77 | — | — | |
| SCHEMBL9063237 | 0.76 | TRIM24 (0.39) | — | |
| SCHEMBL9063242 | 0.76 | TRIM24 (0.39) | — | |
| SCHEMBL9063244 | 0.76 | TRIM24 (0.39) | — |
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 181 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119751435-A | Near infrared fluorescence and photoacoustic dual-mode small molecular probe based on nitroreductase activation, preparation method and application thereof | 重庆医科大学国际体外诊断研究院 | 2025-04-04 | — | — | CN | claimed |
| CN-119661492-A | Red light-emitting multifunctional fluorescent probe and preparation method and application thereof | 新疆农业大学 | 2025-03-21 | — | — | CN | claimed |
| CN-119330950-A | Tumor targeting near-infrared copper ion fluorescent probe and preparation and application thereof | 中国人民解放军空军军医大学 | 2025-01-21 | — | — | CN | claimed |
| CN-119320384-A | Near-infrared ferrous ion fluorescent probe and preparation and application thereof | 中国人民解放军空军军医大学 | 2025-01-17 | — | — | CN | claimed |
| CN-118852132-A | AChE sensitive NIR probe with BBB penetrability and preparation method and application thereof | 吉林大学 | 2024-10-29 | — | — | CN | claimed |
| CN-118652232-A | Novel ratio near infrared fluorescent probe for detecting sulfur dioxide, preparation method and application thereof | 齐鲁工业大学(山东省科学院) | 2024-09-17 | — | — | CN | claimed |
| CN-117327049-A | Thiopyran nitrile near-infrared fluorescent dye and preparation method thereof | 东南大学 | 2024-01-02 | — | — | CN | claimed |
| CN-114674900-B | Photoelectrochemical microsensor based on small molecular probe and preparation method and application thereof | 湖北大学 | 2023-09-22 | — | — | CN | claimed |
| CN-115232152-B | Fluorescent probe for detecting hypochlorous acid and preparation method and application thereof | 中国人民解放军空军军医大学 | 2023-06-23 | — | — | CN | claimed |
| CN-113980036-B | Near infrared fluorescent probe with dual responses of alkalinity, active oxygen and active nitrogen, and preparation method and application thereof | 复旦大学 | 2023-05-30 | — | — | CN | claimed |
| CN-115232152-A | Fluorescent probe for detecting hypochlorous acid and preparation method and application thereof | 中国人民解放军空军军医大学 | 2022-10-25 | — | — | CN | claimed |
| CN-114674900-A | Photoelectrochemical microsensor based on small molecular probe and preparation method and application thereof | 湖北大学 | 2022-06-28 | — | — | CN | claimed |
| CN-113980036-A | Alkaline, active oxygen and active nitrogen dual-response near-infrared fluorescent probe and preparation method and application thereof | 复旦大学 | 2022-01-28 | — | — | CN | claimed |
| CN-119661492-B | Red light-emitting multifunctional fluorescent probe and preparation method and application thereof | 新疆农业大学 | 2025-09-26 | — | — | CN | disclosed |
| CN-119751435-A | Near infrared fluorescence and photoacoustic dual-mode small molecular probe based on nitroreductase activation, preparation method and application thereof | 重庆医科大学国际体外诊断研究院 | 2025-04-04 | — | — | CN | disclosed |
| CN-119684364-A | Simultaneous detection of ONOO−Dual-channel fluorescent probe with viscosity and preparation method thereof | 长春吉智荧科生物科技有限公司 | 2025-03-25 | — | — | CN | disclosed |
| WO-2002068384-A2 | (2-HYDROXY)ETHYL-THIOUREAS USEFUL AS MODULATORS OF ALPHA2B ADRENERGIC RECEPTORS | ALLERGAN, INC. (US) | 2002-09-06 | — | — | WO | disclosed |
| US-5986131-A | UNSATURATED CARBOXYLIC ACID DERIVATIVES AS LIGANDS AND RETINOIC ACID RECEPTORS | HOFFMANN-LA ROCHE INC. (US) | 1999-11-16 | — | — | US | disclosed |
| EP-0728742-B1 | Novel retinoids | HOFFMANN LA ROCHE (CH) | 1999-10-20 | — | — | EP | disclosed |
| EP-0728742-A2 | Novel retinoids | F. HOFFMANN-LA ROCHE AG (CH) | 1996-08-28 | — | — | EP | disclosed |