⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL795334 | 0.77 | HTR6 (0.32) | — | |
| SCHEMBL6064691 | 0.72 | HTR6 (0.33) | — | |
| SCHEMBL28182882 | 0.72 | MAPT (0.32) | — | |
| SCHEMBL7598103 | 0.71 | KDM4E (0.36) | — | |
| SCHEMBL8626352 | 0.71 | CYP2D6 (0.35) | — | |
| SCHEMBL550007 | 0.69 | HTR2A (0.38) | — | |
| SCHEMBL137961 | 0.69 | HTR2A (0.38) | — | |
| SCHEMBL7063969 | 0.69 | — | — | |
| SCHEMBL7941885 | 0.68 | HTR2A (0.36) | — | |
| SCHEMBL7066150 | 0.68 | GPR3 (0.31) | — |
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-1629973-B1 | Laminate | TOSOH CORP (JP) | 2012-03-28 | — | — | EP | disclosed |
| US-7544422-B2 | Laminate | TOSOH CORPORATION (JP) | 2009-06-09 | — | — | US | disclosed |
| EP-1629973-A1 | Laminate | Tosoh Corporation (JP) | 2006-03-01 | — | — | EP | disclosed |
| US-20060024519-A1 | Laminate | TOSOH CORPORATION | 2006-02-02 | — | — | US | disclosed |