⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL460298 | 0.86 | PGR (0.31) | — | |
| SCHEMBL2301308 | 0.80 | — | — | |
| SCHEMBL6271793 | 0.80 | — | — | |
| SCHEMBL1723731 | 0.79 | PGR (0.40) | — | |
| SCHEMBL2843199 | 0.73 | — | — | |
| SCHEMBL5168856 | 0.72 | — | — | |
| SCHEMBL1929136 | 0.65 | HTR2A (0.37) | — | |
| SCHEMBL30511096 | 0.64 | PGR (0.49) | — | |
| SCHEMBL2942957 | 0.62 | PGR (0.41) | — | |
| SCHEMBL28969992 | 0.61 | PGR (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005060471-A2 | LUMINESCENT MATERIAL COMPOSITIONS, DEVICES,AND METHODS OF USING | KELLY STEPHEN M (GB) | 2005-07-07 | — | — | WO | claimed |
| US-20050238913-A1 | Luminescent material compositions, devices and methods of using | KELLY STEPHEN M | 2005-10-27 | — | — | US | disclosed |
| WO-2005060471-A2 | LUMINESCENT MATERIAL COMPOSITIONS, DEVICES,AND METHODS OF USING | KELLY STEPHEN M (GB) | 2005-07-07 | — | — | WO | disclosed |