⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4968923 | 0.86 | — | — | |
| SCHEMBL247230 | 0.84 | — | — | |
| SCHEMBL5701635 | 0.83 | — | — | |
| SCHEMBL11040136 | 0.81 | CES2 (0.30) | — | |
| SCHEMBL7053048 | 0.81 | — | — | |
| SCHEMBL10934209 | 0.81 | — | — | |
| SCHEMBL153061 | 0.80 | — | — | |
| SCHEMBL1718927 | 0.79 | — | — | |
| SCHEMBL5701780 | 0.78 | — | — | |
| SCHEMBL332044 | 0.77 | CES2 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040198938-A1 | Monomers, polymers and ophthalmic lenses | JOHNSON & JOHNSON VISION CARE, INC. | 2004-10-07 | — | — | US | disclosed |
| EP-1424339-A1 | MONOMERS, POLYMERS AND OPHTHALMIC LENSES | Johson & Johnson Vision Care Inc. (US) | 2004-06-02 | — | — | EP | disclosed |