⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27920660 | 0.89 | — | — | |
| SCHEMBL27513464 | 0.86 | — | — | |
| SCHEMBL27206851 | 0.83 | — | — | |
| SCHEMBL7060717 | 0.83 | — | — | |
| SCHEMBL27679602 | 0.83 | — | — | |
| SCHEMBL27920656 | 0.83 | — | — | |
| SCHEMBL28842895 | 0.82 | — | — | |
| SCHEMBL27566441 | 0.81 | — | — | |
| SCHEMBL28635154 | 0.80 | CYP3A4 (0.30) | — | |
| SCHEMBL8489556 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117599850-A | Nano composite material of fullerene/photosensitizer, preparation method and application thereof | 中国科学院化学研究所 | 2024-02-27 | — | — | CN | disclosed |
| US-6894161-B2 | Methods and compositions for photo-cross linking photoactive compounds to target tissue | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2005-05-17 | — | — | US | disclosed |
| US-20030013696-A1 | Methods and compositions for photo-cross linking photoactive compounds to target tissue | BRITISH COLUMBIA, UNIVERSITY OF, THE (CA) | 2003-01-16 | — | — | US | disclosed |
| WO-2002076453-A1 | METHODS AND COMPOSITIONS FOR PHOTO-CROSS LINKING PHOTOACTIVE COMPOUNDS TO TARGET TISSUE | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2002-10-03 | — | — | WO | disclosed |