⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5176273 | 0.91 | — | — | |
| SCHEMBL7125348 | 0.59 | NCOA3 (0.34) | — | |
| SCHEMBL28869249 | 0.59 | — | — | |
| SCHEMBL6131150 | 0.58 | TTR (0.30) | — | |
| SCHEMBL29473567 | 0.58 | IDO1 (0.31) | — | |
| Perchlorate SCHEMBL9692255 | 0.57 | — | — | |
| SCHEMBL27458463 | 0.57 | IDO1 (0.30) | — | |
| SCHEMBL28599272 | 0.56 | — | — | |
| SCHEMBL30801318 | 0.56 | — | — | |
| SCHEMBL27839465 | 0.55 | 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-6506539-B2 | Recording; compact disks, television; complex of cyanine dye and tetracyanoquinodmethane compound | FUJI PHOTO FILM CO., LTD. (JP) | 2003-01-14 | — | — | US | disclosed |
| US-20020025491-A1 | Dye complex and optical information recording medium | FUJIFILM CORPORATION (JP) | 2002-02-28 | — | — | US | disclosed |
| EP-1142961-A2 | Dye complex and optical information recording medium | FUJI PHOTO FILM CO., LTD. (JP) | 2001-10-10 | — | — | EP | disclosed |