⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22607984 | 0.97 | TSHR (0.37) | — | |
| SCHEMBL28763766 | 0.97 | — | — | |
| SCHEMBL31469567 | 0.97 | TSHR (0.37) | — | |
| Hydrochloric Acid SCHEMBL28592493 | 0.97 | TSHR (0.37) | — | |
| SCHEMBL29160694 | 0.84 | ALDH1A1 (0.34) | — | |
| SCHEMBL16566533 | 0.82 | ALDH1A1 (0.50) | — | |
| SCHEMBL10649685 | 0.81 | — | — | |
| SCHEMBL8719 | 0.79 | TSHR (0.39) | — | |
| SCHEMBL7631451 | 0.79 | TSHR (0.39) | — | |
| SCHEMBL4825183 | 0.73 | — | — |
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
Appears in 12611 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119490523-A | Quaternary carbon chiral allylgem-silicon boron compound, synthesis method thereof and application thereof in allylboration reaction | 四川大学 | 2025-02-21 | — | — | CN | claimed |
| CN-119490376-A | Method for preparing alkylamide | 中国科学院大连化学物理研究所 | 2025-02-21 | — | — | CN | claimed |
| CN-116003460-B | Method for synthesizing optical active organosilicon compound by asymmetric conjugate addition | 河南师范大学 | 2025-02-07 | — | — | CN | claimed |
| CN-119192458-A | Thiazolinone-based acrylic acid silane ester self-polishing antifouling resin, and preparation method and application thereof | 哈尔滨工程大学 | 2024-12-27 | — | — | CN | claimed |
| CN-116425760-B | Synthesis method of chiral (-) -cephalotaxine, intermediate and analogue thereof | 兰州大学 | 2024-11-26 | — | — | CN | claimed |
| CN-108905883-B | Preparation method of Si-C-Si type anionic organosilicon surfactant | 江西新嘉懿新材料有限公司 | 2024-08-27 | — | — | CN | claimed |
| CN-118344405-A | Organic electroluminescent material and device thereof | 北京夏禾科技有限公司 | 2024-07-16 | — | — | CN | claimed |
| CN-118324823-A | Heterofluorene rare earth compound, preparation method thereof and application thereof in olefin polymerization | 中国科学院长春应用化学研究所 | 2024-07-12 | — | — | CN | claimed |
| CN-118284277-A | Electroluminescent device | 北京夏禾科技有限公司 | 2024-07-02 | — | — | CN | claimed |
| CN-118255814-A | Electroluminescent material and device thereof | 北京夏禾科技有限公司 | 2024-06-28 | — | — | CN | claimed |
| EP-0269573-A2 | Liquid photoinitiating mixture | CIBA-GEIGY AG (CH) | 1988-06-01 | — | — | EP | claimed |
| EP-0269236-A1 | Process for synthesis of a chiral azetidinone | MERCK & CO. INC. (US) | 1988-06-01 | — | — | EP | claimed |
| CN-87105345-A | Tertiary amine compound | — | 1988-02-03 | — | — | CN | claimed |
| EP-0253501-A2 | N-disubstituted cycloalkylmethyl amines useful as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-20 | — | — | EP | claimed |
| US-4554363-A | Process for the preparation of carbacyclin intermediates | SCHERING AKTIENGESELLSCHAFT (DE) | 1985-11-19 | — | — | US | claimed |
| EP-0105267-A1 | METHOD FOR THE PREPARATION OF INTERMEDIARY COMPOUNDS OF CARBACYCLIN. | SCHERING AG (DE) | 1984-04-18 | — | — | EP | claimed |
| US-4424343-A | Preparation of 1-N- ω-amino-α-hydroxyalkanoyl!kanamycin polysilylates and products | BRISTOL MYERS COMPANY (US) | 1984-01-03 | — | — | US | claimed |
| WO-1983001449-A1 | METHOD FOR THE PREPARATION OF INTERMEDIARY COMPOUNDS OF CARBACYCLIN | VORBRÜGGEN, Helmut | 1983-04-28 | — | — | WO | claimed |
| US-4267117-A | INTERMEDIATES FOR 1A-HYDROXYLATED CALCIFEROLS | THE UPJOHN COMPANY (US) | 1981-05-12 | — | — | US | claimed |
| US-4206131-A | 1A-HYDROXYLATED CALCIFEROLS | THE UPJOHN COMPANY (US) | 1980-06-03 | — | — | US | claimed |