⚠ 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6494188 | 0.92 | ALDH1A1 (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL6323631 | 0.92 | — | — | |
| Trifluoroacetic Acid SCHEMBL21904726 | 0.92 | ALDH1A1 (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL7814389 | 0.91 | ALDH1A1 (0.44) | — | |
| Trifluoroacetic Acid SCHEMBL4598430 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL30657022 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL474 | 0.91 | — | — | |
| Trifluoroacetic Acid SCHEMBL2484766 | 0.91 | ALDH1A1 (0.44) | — | |
| Trifluoroacetic Acid SCHEMBL28579679 | 0.88 | ALDH1A1 (0.38) | — | |
| Trifluoroacetic Acid SCHEMBL4700635 | 0.88 | — | — |
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-105633460-A | Lithium ion secondary battery electrolyte and lithium ion secondary battery | CONTEMPORARY AMPEREX TECHNOLOGY CO LTD | 2016-06-01 | — | — | CN | claimed |
| CN-114361590-B | Electrolyte additive for lithium ion battery, electrolyte and lithium ion battery | 松山湖材料实验室 | 2023-07-25 | — | — | CN | disclosed |
| WO-2020055010-A1 | METHOD FOR PREPARING HEPTAFLUOROISOPROPYL TRIFLUOROVINYL ETHER | 한국화학연구원 | 2020-03-19 | — | — | WO | disclosed |
| CN-105633460-B | Lithium ion secondary battery electrolyte and lithium ion secondary battery | 宁德时代新能源科技股份有限公司 | 2019-01-11 | — | — | CN | disclosed |
| CN-105038054-B | Water transfer printing film | 嘉善宏瑞包装材料有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-104999822-B | The preparation method of PVA water transfer printing film | 嘉善宏瑞包装材料有限公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-105633460-A | Lithium ion secondary battery electrolyte and lithium ion secondary battery | CONTEMPORARY AMPEREX TECHNOLOGY CO LTD | 2016-06-01 | — | — | CN | disclosed |
| CN-105315347-A | NOVEL PEPTIDE COMPOUNDS | INT INST CANCER IMMUNOLOGY INC | 2016-02-10 | — | — | CN | disclosed |
| CN-101336249-A | Novel Peptide Compounds | INT INST CANCER IMMUNOLOGY INC (JP) | 2008-12-31 | — | — | CN | disclosed |
| CN-1057099-C | Synthetic peptides, intermediates therefor and process for producing the same | MITSUBISHI TOYKO PHARMACEUTICA (JP) | 2000-10-04 | — | — | CN | disclosed |
| CN-1136813-A | Novel synthetic peptide, lung surfactant containing the same and remedy for respiratory distress syndrome | TOKYO TANABE PHARMACEUTICAL CO (JP) | 1996-11-27 | — | — | CN | disclosed |