⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8503776 | 0.85 | CHRM1 (0.34) | — | |
| SCHEMBL10476486 | 0.79 | SMN1; SMN2 (0.43) | — | |
| SCHEMBL454677 | 0.77 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL277036 | 0.75 | PPARA (0.33) | — | |
| SCHEMBL2465321 | 0.73 | TSHR (0.36) | — | |
| SCHEMBL15939803 | 0.72 | CHRM1 (0.33) | — | |
| SCHEMBL27847755 | 0.71 | TSHR (0.38) | — | |
| SCHEMBL1741551 | 0.71 | TET2 (0.32) | — | |
| SCHEMBL7760003 | 0.69 | — | — | |
| SCHEMBL6545386 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1534759-B1 | MACROMER FORMING CATALYSTS | JOHNSON & JOHNSON VISION CARE (US) | 2009-09-09 | — | — | EP | claimed |
| EP-0530360-A4 | — | PHILLIPS PETROLEUM CO (US) | 1995-04-26 | — | — | EP | disclosed |
| EP-0552306-A1 | NOVEL SILICONE-CONTAINING POLYMERS AND OXYGEN PERMEABLE HYDROPHILIC CONTACT LENSES THEREFROM | PERMEABLE TECHNOLOGIES, INC. (US) | 1993-07-28 | — | — | EP | disclosed |
| EP-0530360-A1 | GLASS-REINFORCED GRAFTED BRANCHED HIGHER ALPHA-OLEFINS | PHILLIPS PETROLEUM COMPANY (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1992007013-A1 | NOVEL SILICONE-CONTAINING POLYMERS AND OXYGEN PERMEABLE HYDROPHILIC CONTACT LENSES THEREFROM | PERMEABLE TECHNOLOGIES, INC. (US) | 1992-04-30 | — | — | WO | disclosed |