⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1898062 | 0.98 | — | — | |
| Fluoride SCHEMBL1896450 | 0.98 | — | — | |
| SCHEMBL28841374 | 0.85 | — | — | |
| SCHEMBL9959999 | 0.85 | — | — | |
| Iodide SCHEMBL15488480 | 0.83 | — | — | |
| SCHEMBL425212 | 0.81 | — | — | |
| Bromide SCHEMBL5898634 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL4211298 | 0.79 | — | — | |
| Fluoride SCHEMBL4200165 | 0.79 | — | — | |
| SCHEMBL898866 | 0.79 | ALDH1A1 (0.36) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104649978-B | Compound, nonaqueous electrolyte, and electricity storage device | 株式会社半导体能源研究所 | 2019-08-27 | — | — | CN | disclosed |
| CN-107069074-B | Compound, nonaqueous electrolyte and electrical storage device | 株式会社半导体能源研究所 | 2019-01-25 | — | — | CN | disclosed |
| CN-107069074-A | Compound, nonaqueous electrolyte and electrical storage device | 株式会社半导体能源研究所 | 2017-08-18 | — | — | CN | disclosed |
| CN-104649978-A | Compound, nonaqueous electrolyte, and electricity storage device | SEMICONDUCTOR ENERGY LAB | 2015-05-27 | — | — | CN | disclosed |
| US-20150140449-A1 | COMPOUND, NONAQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2015-05-21 | — | — | US | disclosed |
| EP-1698606-B1 | FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME | SUMITOMO CHEMICAL CO (JP) | 2013-02-20 | — | — | EP | disclosed |
| US-7939697-B2 | Fluorinating agent and method for producing fluorine-containing compound using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-05-10 | — | — | US | disclosed |
| US-20090287025-A1 | Fluorinating agent and method for producing fluorine-containing compound using the same | SUMITOMO CHEMICAL COMPANY, LIMITED | 2009-11-19 | — | — | US | disclosed |
| US-7569703-B2 | Fluorinating agent and method for producing fluorine-containing compound using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-08-04 | — | — | US | disclosed |
| US-20070135634-A1 | Fluorinating agent and method for producing fluorine-containing compound using the same | SUMITOMO CHEMICAL COMPANY, LIMITED | 2007-06-14 | — | — | US | disclosed |
| EP-1698606-A1 | FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME | Sumitomo Chemical Company, Limited (JP) | 2006-09-06 | — | — | EP | disclosed |