⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5837790 | 0.78 | — | — | |
| SCHEMBL13720530 | 0.76 | — | — | |
| SCHEMBL5837534 | 0.76 | — | — | |
| SCHEMBL8394810 | 0.76 | — | — | |
| SCHEMBL7645747 | 0.73 | — | — | |
| SCHEMBL10781891 | 0.73 | CA1 (0.30) | — | |
| SCHEMBL194317 | 0.71 | THRB (0.30) | — | |
| SCHEMBL15211046 | 0.70 | — | — | |
| SCHEMBL18398447 | 0.69 | — | — | |
| SCHEMBL3757521 | 0.68 | THRB (0.39) | — |
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-7838691-B2 | Palmerolides: methods of preparation and derivatives thereof | BOARD OF REGENTS, OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2010-11-23 | — | — | US | disclosed |
| WO-2008124072-A1 | PALMEROLIDES: METHODS OF PREPARATION AND DERIVATIVES THEREOF | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2008-10-16 | — | — | WO | disclosed |
| US-20080249162-A1 | PALMEROLIDES: METHODS OF PREPARATION AND DERIVATIVES THEREOF | THE BOARD OF REGENTS, OF THE UNIVERSITY OF TEXAS SYSTEM | 2008-10-09 | — | — | US | disclosed |