⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8952132 | 1.00 | — | — | |
| SCHEMBL28064599 | 0.79 | — | — | |
| SCHEMBL4894741 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL4894736 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL29628870 | 0.77 | — | — | |
| SCHEMBL17811626 | 0.74 | — | — | |
| SCHEMBL19667932 | 0.74 | — | — | |
| SCHEMBL19667931 | 0.74 | — | — | |
| SCHEMBL16247241 | 0.74 | — | — | |
| SCHEMBL24511860 | 0.72 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114556656-A | Electrolyte solution for lithium ion battery cells | 霍尼韦尔国际公司 | 2022-05-27 | — | — | CN | claimed |
| EP-3997753-A1 | ELECTROLYTE SOLUTION FOR A LITHIUM ION CELL | Honeywell International Inc. (US) | 2022-05-18 | — | — | EP | claimed |
| CN-114556656-A | Electrolyte solution for lithium ion battery cells | 霍尼韦尔国际公司 | 2022-05-27 | — | — | CN | disclosed |
| EP-3997753-A1 | ELECTROLYTE SOLUTION FOR A LITHIUM ION CELL | Honeywell International Inc. (US) | 2022-05-18 | — | — | EP | disclosed |
| US-5514816-A | REACTION OF DIFLUOROBENZO-1,3-DIOXOLE WITH METAL COMPOUNDS FOR INSECTICIDES | CIBA-GEIGY CORPORATION (US) | 1996-05-07 | — | — | US | disclosed |
| US-5496848-A | Process for the preparation of substituted difluorobenzo-1,3-dioxoles | CIBA-GEIGY CORPORATION (US) | 1996-03-05 | — | — | US | disclosed |
| US-5493032-A | INSECTICIDES, MICROBIOCIDES | CIBA-GEIGY CORPORATION (US) | 1996-02-20 | — | — | US | disclosed |
| EP-0333658-B1 | Process for the preparation of substituted difluorbenzo-1,3-dioxoles | CIBA GEIGY AG (CH) | 1995-07-26 | — | — | EP | disclosed |
| US-5420301-A | Process for the preparation of substituted difluorobenzo-1,3-dioxoles | CIBA-GEIGY CORPORATION (US) | 1995-05-30 | — | — | US | disclosed |
| US-5281718-A | Reacting in one pot reaction 2,2-difluorobenzodioxole with an organometal compound or metal to form 4-metallo-2,2-difluorobenzodioxole, reacting with unsaturated nitrile, then with isocyanide | CIBA-GEIGY CORPORATION (US) | 1994-01-25 | — | — | US | disclosed |
| US-5194628-A | Reacting metallo-difluorobenzodioxole with unsaturated nitrile and then with sulfonylmethyl isocyanide | CIBA-GEIGY CORPORATION (US) | 1993-03-16 | — | — | US | disclosed |
| EP-0333658-A2 | Process for the preparation of substituted difluorbenzo-1,3-dioxoles | CIBA-GEIGY AG (CH) | 1989-09-20 | — | — | EP | disclosed |