⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29105516 | 0.86 | — | — | |
| SCHEMBL12400371 | 0.86 | — | — | |
| SCHEMBL25211906 | 0.84 | HTR2A (0.42) | — | |
| SCHEMBL14696607 | 0.77 | L3MBTL1 (0.53) | — | |
| SCHEMBL3282927 | 0.74 | — | — | |
| SCHEMBL1849977 | 0.74 | — | — | |
| SCHEMBL15292025 | 0.74 | — | — | |
| SCHEMBL63217 | 0.74 | L3MBTL1 (0.40) | — | |
| SCHEMBL3636886 | 0.74 | — | — | |
| SCHEMBL28058653 | 0.74 | — | — |
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 440 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119708057-A | Preparation method of N, N' -bis (2-bromo/chloroethyl) diaminophosphonic acid (1-methyl-4-nitro-1H-imidazole-2-cyanomethyl) ester | 常州大学 | 2025-03-28 | — | — | CN | claimed |
| CN-119243271-A | Electrolytic copper plating solution for filling X-shaped holes of printed circuit and application thereof | 电子科技大学 | 2025-01-03 | — | — | CN | claimed |
| CN-110501436-A | In relation to the detection method of substance in Tinidazole pharmaceutical composition | LIVZON GROUP LIVZON PHARMACEUTICAL FACTORY | 2019-11-26 | — | — | CN | claimed |
| US-10224485-B2 | Process for preparing a crystalline organic semiconductor material | BASF SE (DE) | 2019-03-05 | — | — | US | claimed |
| CN-106892788-B | Hexanitrohexaazaisowurtzitane and imidazoles cocrystallized explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2018-09-25 | — | — | CN | claimed |
| CN-106905089-B | The cocrystallized explosive and preparation method thereof of sym-trinitrobenzene and azole explosive | 中国工程物理研究院化工材料研究所 | 2018-08-14 | — | — | CN | claimed |
| CN-106905089-A | Cocrystallized explosive of sym-trinitrobenzene and azole explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2017-06-30 | — | — | CN | claimed |
| CN-106892788-A | Hexanitrohexaazaisowurtzitane and imidazoles cocrystallized explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2017-06-27 | — | — | CN | claimed |
| US-20170012208-A1 | ORGANIC SEMICONDUCTOR FORMULATIONS | USINVEST LLC | 2017-01-12 | — | — | US | claimed |
| CN-101948435-B | Preparation method of 5-chlorine-1-methyl-4-nitro iminazole | UNIV EAST CHINA NORMAL | 2012-03-07 | — | — | CN | claimed |
| CN-101948435-A | Preparation method of 5-chlorine-1-methyl-4-nitro iminazole | UNIV EAST CHINA NORMAL | 2011-01-19 | — | — | CN | claimed |
| WO-2007065016-A2 | METHODS AND COMPOSITIONS TO IMPROVE ACTIVITY AND REDUCE TOXICITY OF STENTS | AU JESSIE L S (US) | 2007-06-07 | — | — | WO | claimed |
| US-20060128742-A1 | Cell migration inhibiting compositions and methods and compositions for treating cancer | AVOLIX PHARMACEUTICALS, INC. | 2006-06-15 | — | — | US | claimed |
| US-4873228-A | 2-oxo-4-carboxy-pyrimidines and their use as anti-malaria and anti-cancer agents | THE UNIVERSITY OF MELBOURNE (AU) | 1989-10-10 | — | — | US | claimed |
| US-3998806-A | ANTI-LEUKEMIA AGENTS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1976-12-21 | — | — | US | claimed |
| CN-117777196-B | Method for synthesizing Ai Fulin amide isomer derivative | 常州大学 | 2026-05-19 | — | — | CN | disclosed |
| EP-4688786-A2 | 1-THIOXO-2,4-DIHYDROTHIENO[2,3-E][1,2,4]TRIAZOLO[4,3-A]PYRIMIDIN-5(1 H)-ONE DERIVATIVES AS ALLOSTERIC INHIBITORS OF THE POLO-LIKE KINASE 1 (PLK1) POLO BOX DOMAIN (PBD) FOR THE TREATMENT OF CANCER | The United States of America, as represented by the Secretary, Department of Health and Human Services (US) | 2026-02-11 | — | — | EP | disclosed |
| US-4880892-A | PHOSPHONIUM OR PHOSPHORANE CATALYST, PROTECTIVE COATINGS | CIBA-GEIGY CORPORATION (US) | 1989-11-14 | — | — | US | disclosed |
| CN-1035111-A | Hydroxyalkyl agent preparation method, gained new preparation and application thereof like this | RHONE POULENC SANTE (FR) | 1989-08-30 | — | — | CN | disclosed |
| EP-0293742-A1 | Process for the production of 4-nitro-5-imidazolylethers and -thioethers | BASF Aktiengesellschaft (DE) | 1988-12-07 | — | — | EP | disclosed |