⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7769487 | 0.86 | — | — | |
| SCHEMBL28883586 | 0.69 | — | — | |
| SCHEMBL7771357 | 0.69 | — | — | |
| SCHEMBL44131 | 0.64 | — | — | |
| SCHEMBL7769480 | 0.62 | — | — | |
| SCHEMBL1465332 | 0.61 | — | — | |
| SCHEMBL13943202 | 0.61 | — | — | |
| SCHEMBL2201542 | 0.61 | — | — | |
| SCHEMBL18779 | 0.61 | — | — | |
| SCHEMBL4011609 | 0.61 | BRD4 (0.30) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11091498-B2 | Topoisomerase poisons | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2021-08-17 | — | — | US | disclosed |
| US-20200325149-A1 | TOPOISOMERASE POISONS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2020-10-15 | — | — | US | disclosed |
| EP-3442979-A1 | TOPOISOMERASE POISONS | Rutgers, the State University of New Jersey (US) | 2019-02-20 | — | — | EP | disclosed |
| WO-2017176648-A1 | TOPOISOMERASE POISONS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-10-12 | — | — | WO | disclosed |
| US-9321781-B2 | Topoisomerase inhibitors | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2016-04-26 | — | — | US | disclosed |
| US-20120237531-A1 | TOPOISOMERASE INHIBITORS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY | 2012-09-20 | — | — | US | disclosed |
| WO-2010127363-A1 | TOPOSIOMERASE INHIBITORS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2010-11-04 | — | — | WO | disclosed |
| EP-0765879-B1 | 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests | SANKYO CO (JP) | 2001-02-14 | — | — | EP | disclosed |
| US-5861429-A | MITICIDES AND ANTHELMINTICS | SANKYO COMPANY, LIMITED (JP) | 1999-01-19 | — | — | US | disclosed |
| EP-0765879-A1 | 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests | SANKYO COMPANY LIMITED (JP) | 1997-04-02 | — | — | EP | disclosed |