⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6741129 | 0.96 | CNR1 (0.33) | — | |
| SCHEMBL6731783 | 0.92 | HTR1D (0.31) | — | |
| SCHEMBL6739297 | 0.87 | CNR2 (0.33) | — | |
| SCHEMBL6737007 | 0.86 | CYP3A4 (0.32) | — | |
| SCHEMBL6740640 | 0.85 | CYP3A4 (0.38) | — | |
| SCHEMBL6737466 | 0.84 | CYP3A4 (0.41) | — | |
| SCHEMBL6738572 | 0.83 | CYP3A4 (0.33) | — | |
| SCHEMBL6734837 | 0.82 | CYP3A4 (0.39) | — | |
| SCHEMBL6738876 | 0.82 | CYP3A4 (0.37) | — | |
| SCHEMBL6740428 | 0.81 | CYP3A4 (0.38) | — |
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-6682785-B2 | A FLUOROANTHRACENE COMPOUNDS; HEAT RESISTANCE, RADIATION RESISTANCE, PHOTOSTABILITY | CLARIANT FINANCE (BVI) LIMITED (VG) | 2004-01-27 | — | — | US | disclosed |
| US-20030118749-A1 | A fluoroanthracene compounds; heat resistance, radiation resistance, photostability | CLARIANT INTERNATIONAL LTD. | 2003-06-26 | — | — | US | disclosed |