⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6435164 | 0.70 | — | — | |
| SCHEMBL28276115 | 0.68 | — | — | |
| SCHEMBL17451068 | 0.65 | — | — | |
| SCHEMBL16449173 | 0.65 | CES2 (0.50) | — | |
| Butyric Acid SCHEMBL28259845 | 0.64 | OR51E2 (0.64) | — | |
| SCHEMBL7112645 | 0.62 | CES2 (0.36) | — | |
| SCHEMBL3940610 | 0.60 | — | — | |
| SCHEMBL4331446 | 0.59 | — | — | |
| Glycerin SCHEMBL11146168 | 0.57 | LMNA (0.56) | — | |
| SCHEMBL4331467 | 0.57 | OR51E2 (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0770888-B1 | Low water-absorptive ocular lens material, low water-absorptive ocular lens shaped product made thereof, low water-absorptive ocular lens made thereof and process for its production | MENICON CO LTD (JP) | 2004-08-04 | — | — | EP | claimed |
| EP-1867683-B1 | NOVEL POLYMERIZABLE DYE AND OPHTHALMIC LENS CONTAINING THE SAME | MENICON CO LTD (JP) | 2012-10-17 | — | — | EP | disclosed |
| EP-1867683-A1 | NOVEL POLYMERIZABLE DYE AND OPHTHALMIC LENS CONTAINING THE SAME | MENICON CO., LTD. (JP) | 2007-12-19 | — | — | EP | disclosed |