⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27689491 | 0.93 | TSHR (0.31) | — | |
| SCHEMBL5008757 | 0.93 | TSHR (0.31) | — | |
| SCHEMBL6061282 | 0.81 | — | — | |
| SCHEMBL11113803 | 0.74 | — | — | |
| SCHEMBL10801938 | 0.74 | MAPT (0.30) | — | |
| SCHEMBL10318677 | 0.74 | — | — | |
| SCHEMBL7210267 | 0.72 | — | — | |
| SCHEMBL9845756 | 0.72 | — | — | |
| SCHEMBL11564136 | 0.71 | — | — | |
| SCHEMBL28530400 | 0.71 | CYP2A6 (0.36) | — |
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-20030116273-A1 | Method of bonding an optical part | NIPPON SHEET GLASS CO., LTD. (JP) | 2003-06-26 | — | — | US | disclosed |
| EP-1312659-A1 | ADHESIVE COMPOSITION AND OPTICAL DEVICE USING THE SAME | Nippon Sheet Glass Co., Ltd. (JP) | 2003-05-21 | — | — | EP | disclosed |