⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1783787 | 0.88 | — | — | |
| SCHEMBL7083473 | 0.87 | EPHX1 (0.32) | — | |
| SCHEMBL15227099 | 0.74 | — | — | |
| SCHEMBL3155408 | 0.66 | SHBG (0.40) | — | |
| SCHEMBL3230340 | 0.65 | SHBG (0.32) | — | |
| SCHEMBL3239029 | 0.64 | SHBG (0.36) | — | |
| SCHEMBL6053892 | 0.64 | TDP1 (0.31) | — | |
| SCHEMBL3230899 | 0.64 | SHBG (0.36) | — | |
| SCHEMBL3106546 | 0.64 | SHBG (0.36) | — | |
| SCHEMBL15227009 | 0.61 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7238763-B2 | Unsaturated monocarboxylic ester compounds | KANAGAWA UNIVERSITY AND TAIYO INK MANUFACTURING CO., LTD. (JP) | 2007-07-03 | — | — | US | disclosed |
| EP-1251118-B1 | UNSATURATED MONOCARBOXYLIC ESTER COMPOUND, PROCESS FOR PRODUCING THE SAME, AND COMPOSITION CURABLE WITH ACTINIC ENERGY RAY | UNIV KANAGAWA (JP) | 2006-12-20 | — | — | EP | disclosed |
| US-7057063-B2 | Unsaturated carboxylic ester compound, process for producing the same, and composition curable with actinic energy ray | KANAGAWA UNIVERSITY (JP) | 2006-06-06 | — | — | US | disclosed |
| US-20060030636-A1 | Unsaturated carboxylic ester compound, process for producing the same, and composition curable with actinic energy ray | KANAGAWA UNIVERSITY | 2006-02-09 | — | — | US | disclosed |
| US-20030009053-A1 | Unsaturated monocarboxylic ester compound, process for producing the same, and composition curable with actinic energy ray | KANAGAWA UNIVERSITY (JP) | 2003-01-09 | — | — | US | disclosed |
| EP-1251118-A1 | UNSATURATED MONOCARBOXYLIC ESTER COMPOUND, PROCESS FOR PRODUCING THE SAME, AND COMPOSITION CURABLE WITH ACTINIC ENERGY RAY | Kanagawa University (JP) | 2002-10-23 | — | — | EP | disclosed |