⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL806037 | 1.00 | — | — | |
| SCHEMBL8017037 | 0.74 | — | — | |
| SCHEMBL426820 | 0.69 | — | — | |
| SCHEMBL24197509 | 0.69 | — | — | |
| SCHEMBL2299226 | 0.69 | — | — | |
| SCHEMBL2299224 | 0.69 | — | — | |
| SCHEMBL6022443 | 0.67 | — | — | |
| SCHEMBL6022449 | 0.67 | — | — | |
| SCHEMBL8016794 | 0.67 | — | — | |
| SCHEMBL8016802 | 0.67 | — | — |
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-5731301-A | TREATING CANCER IN MAMMALS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1998-03-24 | — | — | US | disclosed |
| WO-1993009089-A1 | BISTRIAZENES AS CHEMOTHERAPEUTIC AGENTS | THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1993-05-13 | — | — | WO | disclosed |
| WO-1991017753-A1 | BISTRIAZENES AS CHEMOTHERAPEUTIC AGENTS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, U.S. DEPARTMENT OF COMMERCE (US) | 1991-11-28 | — | — | WO | disclosed |