⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6421122 | 1.00 | — | — | |
| SCHEMBL6419751 | 0.89 | — | — | |
| SCHEMBL6419760 | 0.89 | — | — | |
| SCHEMBL12332800 | 0.70 | — | — | |
| SCHEMBL14466848 | 0.70 | — | — | |
| SCHEMBL16656725 | 0.63 | — | — | |
| SCHEMBL19312141 | 0.62 | — | — | |
| SCHEMBL6396152 | 0.60 | — | — | |
| SCHEMBL18517004 | 0.60 | — | — | |
| SCHEMBL27342 | 0.59 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050066453-A1 | Photochromic dye | NEW PRISMATIC ENTERPRISE CO., LTD. (TW) | 2005-03-31 | — | — | US | disclosed |