⚠ 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 | |
|---|---|---|---|---|
| Acrylonitrile SCHEMBL10656106 | 0.91 | TSHR (0.53) | — | |
| 1,3-Propanediol SCHEMBL27090357 | 0.87 | — | — | |
| Acrylonitrile SCHEMBL1325768 | 0.83 | — | — | |
| Acrylonitrile SCHEMBL27433793 | 0.83 | — | — | |
| Acrylonitrile SCHEMBL28206017 | 0.82 | — | — | |
| Acrylonitrile SCHEMBL28085505 | 0.81 | — | — | |
| Acrylonitrile SCHEMBL28206502 | 0.81 | ALDH1A1 (0.82) | — | |
| Acrylonitrile SCHEMBL1331669 | 0.80 | — | — | |
| Acrylonitrile SCHEMBL22582794 | 0.80 | — | — | |
| Acrylonitrile SCHEMBL1330109 | 0.80 | — | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116565157-A | Water system secondary ion battery | 中国科学院理化技术研究所 | 2023-08-08 | — | — | CN | claimed |
| CN-116565193-A | Positive electrode material and secondary ion battery containing same | 中国科学院理化技术研究所 | 2023-08-08 | — | — | CN | claimed |
| US-20230246189-A1 | CLASS OF CATHODE MATERIALS AND SECONDARY ION BATTERIES CONTAINING THESE CATHODE MATERIALS | TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2023-08-03 | — | — | US | claimed |
| EP-4219402-A2 | A CLASS OF CATHODE MATERIALS AND SECONDARY ION BATTERIES CONTAINING THESE CATHODE MATERIALS | Technical Institute of Physics and Chemistry, Chinese Academy of Sciences (CN) | 2023-08-02 | — | — | EP | claimed |
| CN-109316578-B | Musk treasure ointment for treating wind-cold-dampness arthralgia and muscular contracture and preparation method thereof | 杭州仁德医药有限公司 | 2021-06-29 | — | — | CN | claimed |
| CN-109316578-A | The Moschus precious analgesic plaster and preparation method thereof for treating wind-cold-dampness arthralgia and muscle arteries and veins contraction | 杭州仁德医药有限公司 | 2019-02-12 | — | — | CN | claimed |
| CN-116565157-A | Water system secondary ion battery | 中国科学院理化技术研究所 | 2023-08-08 | — | — | CN | disclosed |
| CN-116565193-A | Positive electrode material and secondary ion battery containing same | 中国科学院理化技术研究所 | 2023-08-08 | — | — | CN | disclosed |
| US-20230246189-A1 | CLASS OF CATHODE MATERIALS AND SECONDARY ION BATTERIES CONTAINING THESE CATHODE MATERIALS | TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2023-08-03 | — | — | US | disclosed |
| EP-4219402-A2 | A CLASS OF CATHODE MATERIALS AND SECONDARY ION BATTERIES CONTAINING THESE CATHODE MATERIALS | Technical Institute of Physics and Chemistry, Chinese Academy of Sciences (CN) | 2023-08-02 | — | — | EP | disclosed |
| CN-109316578-B | Musk treasure ointment for treating wind-cold-dampness arthralgia and muscular contracture and preparation method thereof | 杭州仁德医药有限公司 | 2021-06-29 | — | — | CN | disclosed |
| WO-2020032611-A1 | DIISOCYANATE COMPOUND HAVING ANHYDROSUGAR ALCOHOL CORE AND PREPARATION METHOD THEREFOR | 주식회사 삼양사 | 2020-02-13 | — | — | WO | disclosed |
| CN-108752543-B | A kind of synthetic method of polyethylene glycol group block copolymer | 华中科技大学 | 2019-07-23 | — | — | CN | disclosed |
| US-20130295449-A1 | IONIC COMPOUND AND PROCESS FOR PRODUCTION THEREOF, AND ELECTROLYTIC SOLUTION AND ELECTRICAL STORAGE DEVICE EACH UTILIZING THE IONIC COMPOUND | NIPPON SHOKUBAI CO., LTD. (JP) | 2013-11-07 | — | — | US | disclosed |
| CN-102807206-A | Method for preparing mesopore-micropore composite porous carbon on basis of vinylidene chloride polymers | UNIV ZHEJIANG | 2012-12-05 | — | — | CN | disclosed |
| EP-1506239-A2 | SURFACE GRAFT MODIFIED RESINS AND FORMATION THEREOF | Phenomenex, Inc. (US) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003064478-A2 | SURFACE GRAFT MODIFIED RESINS AND FORMATION THEREOF | PHENOMENEX, INC. (US) | 2003-08-07 | — | — | WO | disclosed |
| EP-0076404-B1 | METHOD FOR RECOVERY OF GALLIUM | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-01-29 | — | — | EP | disclosed |
| US-4468374-A | AMIDOOXIME CHELATE RESIN | SIMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-08-28 | — | — | US | disclosed |
| EP-0076404-A1 | Method for recovery of gallium | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-04-13 | — | — | EP | disclosed |