⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8711357 | 0.83 | — | — | |
| SCHEMBL191458 | 0.81 | — | — | |
| SCHEMBL749954 | 0.73 | — | — | |
| SCHEMBL1031819 | 0.71 | — | — | |
| SCHEMBL7505413 | 0.71 | — | — | |
| SCHEMBL9021441 | 0.71 | — | — | |
| SCHEMBL7538801 | 0.71 | — | — | |
| SCHEMBL7297852 | 0.71 | — | — | |
| SCHEMBL1628222 | 0.71 | — | — | |
| SCHEMBL15391349 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1087941-B9 | THIOLESTERS AND USES THEREOF | US HEALTH (US) | 2007-11-07 | — | — | EP | disclosed |
| EP-1087941-B1 | THIOLESTERS AND USES THEREOF | US HEALTH (US) | 2006-08-16 | — | — | EP | disclosed |
| US-6706729-B1 | A METHOD FOR DISSOCIATING A METAL ION FROM A ZINC FINGER-CONTAINING PROTEIN; INHIBITING VIRUS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2004-03-16 | — | — | US | disclosed |
| EP-1087941-A2 | THIOLESTERS AND USES THEREOF | THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, Department of Health and Human Services (US) | 2001-04-04 | — | — | EP | disclosed |
| WO-1999065871-A2 | THIOLESTERS AND USES THEREOF | THE GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1999-12-23 | — | — | WO | disclosed |