⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5956991 | 0.75 | — | — | |
| SCHEMBL7762254 | 0.74 | — | — | |
| SCHEMBL7761509 | 0.71 | — | — | |
| SCHEMBL5606170 | 0.71 | — | — | |
| SCHEMBL5838729 | 0.68 | TSHR (0.37) | — | |
| SCHEMBL28280999 | 0.64 | — | — | |
| SCHEMBL7758722 | 0.62 | — | — | |
| SCHEMBL7758680 | 0.60 | — | — | |
| SCHEMBL28994645 | 0.59 | — | — | |
| SCHEMBL15305899 | 0.59 | — | — |
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-0794440-B1 | Ocular lens and a method for its production | MENICON CO LTD (JP) | 2001-05-23 | — | — | EP | disclosed |
| EP-0794440-A2 | Ocular lens and a method for its production | Menicon Co., Ltd. (JP) | 1997-09-10 | — | — | EP | disclosed |
| EP-0781777-A1 | Silicon-containing compound and ocular lens material | Menicon Co., Ltd. (JP) | 1997-07-02 | — | — | EP | disclosed |