⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL160478 | 0.65 | — | — | |
| SCHEMBL9717122 | 0.63 | — | — | |
| SCHEMBL15939631 | 0.61 | — | — | |
| SCHEMBL528608 | 0.61 | PTGS1 (0.32) | — | |
| SCHEMBL1570545 | 0.61 | PTGS1 (0.32) | — | |
| SCHEMBL9318930 | 0.60 | — | — | |
| SCHEMBL7159918 | 0.57 | ALDH1A1 (0.32) | — | |
| SCHEMBL10376016 | 0.57 | — | — | |
| SCHEMBL9589273 | 0.57 | ALDH1A1 (0.32) | — | |
| SCHEMBL7159922 | 0.57 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080075757-A1 | Dispersions of microemulsions in hydrogels for drug delivery | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. | 2008-03-27 | — | — | US | claimed |
| EP-2856218-A1 | FULLY POLYMERIZED UV BLOCKING SILICONE HYDROGEL LENS | Bausch & Lomb Incorporated (US) | 2015-04-08 | — | — | EP | disclosed |
| WO-2013177008-A1 | FULLY POLYMERIZED UV BLOCKING SILICONE HYDROGEL LENS | BAUSCH & LOMB INCORPORATED (US) | 2013-11-28 | — | — | WO | disclosed |