⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4944398 | 0.79 | — | — | |
| SCHEMBL8912460 | 0.78 | — | — | |
| SCHEMBL3512841 | 0.76 | — | — | |
| SCHEMBL2584566 | 0.76 | — | — | |
| SCHEMBL20356933 | 0.74 | — | — | |
| SCHEMBL1156680 | 0.74 | — | — | |
| SCHEMBL3528839 | 0.74 | TSHR (0.30) | — | |
| SCHEMBL1156682 | 0.74 | — | — | |
| SCHEMBL7780083 | 0.74 | ACE2 (0.47) | — | |
| 2-Methylbutanal SCHEMBL9655227 | 0.72 | FFAR3 (0.39) | — |
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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2864312-B1 | NOVEL ANTI-CANCER THIOPHENE COMPOUNDS | UNIV LEUVEN KATH (BE) | 2021-09-22 | — | — | EP | claimed |
| US-7727321-B2 | Magenta ink for ink-jet recording | BROTHER KOGYO KABUSHIKI KAISHA (JP) | 2010-06-01 | — | — | US | claimed |
| EP-1820830-B1 | Magenta ink for ink-jet recording | BROTHER IND LTD (JP) | 2008-10-29 | — | — | EP | claimed |
| EP-1820830-A1 | Magenta ink for ink-jet recording | BROTHER KOGYO KABUSHIKI KAISHA (JP) | 2007-08-22 | — | — | EP | claimed |
| US-20070186807-A1 | pyrazolylazopyridine-based (or pyrazolylazopyrazine-based) together with at least one dye selected from specific triazinylamino-(phenylazo) naphthol-based dye, C. I. Acid Red 289 having a specific xanthene structure, and C. I. Acid Red 52 having another specific xanthene structure; storage stability | BROTHER KOGYO KABUSHIKI KAISHA (JP) | 2007-08-16 | — | — | US | claimed |
| US-20050124614-A1 | 3,4-Dihydroisoquinolin-1-one derivatives as inducers of apoptosis | AXYS PHARMACEUTICALS, INC. (US) | 2005-06-09 | — | — | US | claimed |
| WO-2004004727-A1 | 3,4-DIHYDROISOQUINOLIN-1-ONE DERIVATIVES AS INDUCERS OF APOPTOSIS | AXYS PHARMACEUTICALS, INC. (US) | 2004-01-15 | — | — | WO | claimed |
| CN-109963922-B | Aldehyde scavenger and method for removing aldehyde | 东曹株式会社 | 2022-09-23 | — | — | CN | disclosed |
| EP-2864312-B1 | NOVEL ANTI-CANCER THIOPHENE COMPOUNDS | UNIV LEUVEN KATH (BE) | 2021-09-22 | — | — | EP | disclosed |
| US-10894898-B2 | Water-based ink for ink-jet recording and ink container | BROTHER KOGYO KABUSHIKI KAISHA (JP) | 2021-01-19 | — | — | US | disclosed |
| US-10611922-B2 | Water-based ink set for ink-jet recording and ink-jet recording apparatus | BROTHER KOGYO KABUSHIKI KAISHA (JP) | 2020-04-07 | — | — | US | disclosed |
| US-20200061225-A1 | ALDEHYDE SCAVENGER AND METHOD FOR REMOVING ALDEHYDES | TOSOH CORPORATION (JP) | 2020-02-27 | — | — | US | disclosed |
| EP-3564334-A1 | ALDEHYDE SCAVENGER AND ALDEHYDE REMOVAL METHOD | Tosoh Corporation (JP) | 2019-11-06 | — | — | EP | disclosed |
| US-5668291-A | THIOSUBSTITUTED PYRIDINES, TREATMENT OF AIDS AND HIV | WARNER-LAMBERT COMPANY (US) | 1997-09-16 | — | — | US | disclosed |
| CN-1155278-A | Arylthio compounds as antibacteral and antiviral agents | WARNER LAMBERT CO (US) | 1997-07-23 | — | — | CN | disclosed |
| EP-0775110-A1 | ARYLTHIO COMPOUNDS AS ANTIBACTERIAL AND ANTIVIRAL AGENTS | WARNER-LAMBERT COMPANY (US) | 1997-05-28 | — | — | EP | disclosed |
| US-5620997-A | VIRICIDES, ANTIINFLAMMATORY AGENTS, ANTIATHEROSCLEROTIC AGENT | WARNER-LAMBERT COMPANY (US) | 1997-04-15 | — | — | US | disclosed |
| WO-1996038144-A1 | ISOTHIAZOLONES | WARNER-LAMBERT COMPANY (US) | 1996-12-05 | — | — | WO | disclosed |
| WO-1996004242-A1 | ARYLTHIO COMPOUNDS AS ANTIBACTERIAL AND ANTIVIRAL AGENTS | WARNER-LAMBERT COMPANY (US) | 1996-02-15 | — | — | WO | disclosed |
| CN-1057269-A | Peptide compounds and preparation thereof | FUJISAWA PHARMACEUTICAL CO (JP) | 1991-12-25 | — | — | CN | disclosed |