⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL956902 | 0.83 | — | — | |
| SCHEMBL1576609 | 0.79 | ALDH1A1 (0.50) | — | |
| SCHEMBL22440700 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL22440712 | 0.75 | — | — | |
| SCHEMBL273257 | 0.74 | CA1 (0.36) | — | |
| SCHEMBL27310015 | 0.74 | — | — | |
| Sulfurous Acid SCHEMBL197348 | 0.72 | CA1 (0.43) | — | |
| SCHEMBL778688 | 0.70 | — | — | |
| SCHEMBL186291 | 0.69 | CA1 (0.31) | — | |
| SCHEMBL2835119 | 0.69 | CA1 (0.31) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117510332-A | New method for synthesizing 6, 8-dichloro octanoic acid ester | 风火轮(上海)生物科技有限公司 | 2024-02-06 | — | — | CN | claimed |
| CN-117510332-A | New method for synthesizing 6, 8-dichloro octanoic acid ester | 风火轮(上海)生物科技有限公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-102079896-B | Water-based ink for ink-jet recording, ink cartridge, and ink-jet recording apparatus | BROTHER IND LTD | 2013-10-23 | — | — | CN | disclosed |
| CN-102079896-A | Water-based ink for ink-jet recording, ink cartridge, and ink-jet recording apparatus | BROTHER IND LTD | 2011-06-01 | — | — | CN | disclosed |
| US-20090054397-A1 | PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUND | OHI NORIHITO | 2009-02-26 | — | — | US | disclosed |
| US-7429609-B2 | Pyrazole compound and medicinal composition containing the same | EISAI R & D MANAGEMENT CO., LTD. (JP) | 2008-09-30 | — | — | US | disclosed |
| EP-1253466-B1 | Diazonium salt and heat-sensitive recording material | FUJI PHOTO FILM CO LTD (JP) | 2006-05-31 | — | — | EP | disclosed |
| US-20050261339-A1 | Pyrazole compound and medicinal composition containing the same | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2005-11-24 | — | — | US | disclosed |
| US-20050208582-A1 | Pyrazole compounds and pharmaceutical compositions comprising the compound | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2005-09-22 | — | — | US | disclosed |
| CN-1656079-A | Pyrazole compounds and pharmaceutical compositions containing the same | EISAI CO LTD (JP) | 2005-08-17 | — | — | CN | disclosed |
| EP-1510516-A1 | PYRAZOLE COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 2005-03-02 | — | — | EP | disclosed |
| US-6703345-B2 | STORAGE PROPERTY BEFORE PRINTING (RAW STORAGE PROPERTY) AND LIGHT- RESISTANCE AFTER PRINTING (IMAGE STORAGE PROPERTY) | FUJI PHOTO FILM CO., LTD. (JP) | 2004-03-09 | — | — | US | disclosed |
| US-20020183204-A1 | Diazonium salt and heat-sensitive recording material | FUJI PHOTO FILM CO., LTD. | 2002-12-05 | — | — | US | disclosed |
| EP-1253466-A1 | Diazonium salt and heat-sensitive recording material | FUJI PHOTO FILM CO., LTD. (JP) | 2002-10-30 | — | — | EP | disclosed |
| EP-0585967-B1 | A process for preparing a silicon containing polymer | MITSUI TOATSU CHEMICALS (JP) | 1996-05-01 | — | — | EP | disclosed |
| EP-0321259-B1 | A process for preparing a silicon containing polymer | MITSUI TOATSU CHEMICALS (JP) | 1995-03-01 | — | — | EP | disclosed |
| EP-0585967-A1 | A process for preparing a silicon containing polymer | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1994-03-09 | — | — | EP | disclosed |
| EP-0321259-A2 | A process for preparing a silicon containing polymer | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1989-06-21 | — | — | EP | disclosed |