⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31490275 | 0.67 | — | — | |
| SCHEMBL2128313 | 0.66 | — | — | |
| SCHEMBL5069787 | 0.66 | — | — | |
| SCHEMBL25306206 | 0.64 | — | — | |
| SCHEMBL29672441 | 0.64 | — | — | |
| SCHEMBL30558225 | 0.64 | — | — | |
| SCHEMBL11506302 | 0.61 | ALDH1A1 (0.32) | — | |
| SCHEMBL2334013 | 0.60 | — | — | |
| SCHEMBL4467080 | 0.59 | — | — | |
| SCHEMBL8837037 | 0.59 | TSHR (0.33) | — |
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-1209492-B1 | Formation of materials such as waveguides with a refractive index step | NAT UNIV IRELAND CORK (IE) | 2004-02-04 | — | — | EP | disclosed |
| US-20020142096-A1 | Induction gelation; optic diffraction; three-dimensional crosslinking | CONNELL ANDREW (IE) | 2002-10-03 | — | — | US | disclosed |
| EP-1209492-A1 | Formation of materials such as waveguides with a refractive index step | National University of Ireland Cork (IE) | 2002-05-29 | — | — | EP | disclosed |