⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28884175 | 0.79 | — | — | |
| SCHEMBL27972467 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL2881286 | 0.78 | TSHR (0.32) | — | |
| SCHEMBL2945619 | 0.77 | — | — | |
| SCHEMBL149032 | 0.74 | ALDH1A1 (0.44) | — | |
| SCHEMBL3310212 | 0.74 | — | — | |
| SCHEMBL26112035 | 0.74 | — | — | |
| SCHEMBL666918 | 0.73 | TSHR (0.50) | — | |
| SCHEMBL13613127 | 0.73 | TSHR (0.50) | — | |
| SCHEMBL10948804 | 0.73 | TSHR (0.38) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1486800-B1 | NON-BIREFRINGENT OPTICAL RESIN MATERIAL AND ITS PRODUCING METHOD | KOIKE YASUHIRO (JP) | 2009-06-03 | — | — | EP | disclosed |
| US-7485676-B2 | Non-birefringent optical resin material and its producing method | KOIKE YASUHIRO | 2009-02-03 | — | — | US | disclosed |
| US-20050119389-A1 | Non-birefringent optical resin material and its producing method | KOIKE YASUHIRO (JP) | 2005-06-02 | — | — | US | disclosed |
| EP-1486800-A1 | NON-BIREFRINGENT OPTICAL RESIN MATERIAL AND ITS PRODUCING METHOD | KOIKE, Yasuhiro (JP) | 2004-12-15 | — | — | EP | disclosed |