⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5784399 | 0.82 | NPSR1 (0.44) | — | |
| SCHEMBL5478658 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL22583552 | 0.79 | HCAR2 (0.40) | — | |
| SCHEMBL28452017 | 0.78 | — | — | |
| SCHEMBL10993833 | 0.77 | — | — | |
| SCHEMBL11209802 | 0.75 | — | — | |
| SCHEMBL22974912 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL10523584 | 0.71 | — | — | |
| SCHEMBL1570545 | 0.70 | PTGS1 (0.32) | — | |
| SCHEMBL528608 | 0.70 | PTGS1 (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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1994021698-A1 | NOVEL FUMARATE AND FUMARAMIDE SILOXANE HYDROGEL COMPOSITIONS | BAUSCH & LOMB INCORPORATED (US) | 1994-09-29 | — | — | WO | claimed |
| WO-2009011703-A1 | TINTED LENS AND METHOD OF MAKING SAME | CHROMAGEN VISION LLC (US) | 2009-01-22 | — | — | WO | disclosed |
| EP-0652823-A1 | PROCESS FOR MAKING SILICONE CONTAINING HYDROGEL LENSES | BAUSCH & LOMB INCORPORATED (US) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994023314-A1 | IMPROVED ITACONATE COPOLYMERIC COMPOSITIONS FOR CONTACT LENSES | POLYMER TECHNOLOGY CORPORATION (US) | 1994-10-13 | — | — | WO | disclosed |
| WO-1994021698-A1 | NOVEL FUMARATE AND FUMARAMIDE SILOXANE HYDROGEL COMPOSITIONS | BAUSCH & LOMB INCORPORATED (US) | 1994-09-29 | — | — | WO | disclosed |
| WO-1994003324-A1 | PROCESS FOR MAKING SILICONE CONTAINING HYDROGEL LENSES | BAUSCH & LOMB INCORPORATED (US) | 1994-02-17 | — | — | WO | disclosed |