⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18027480 | 0.57 | — | — | |
| SCHEMBL4383988 | 0.50 | — | — | |
| SCHEMBL13523738 | 0.45 | — | — | |
| SCHEMBL24459 | 0.45 | — | — | |
| SCHEMBL4584754 | 0.45 | — | — | |
| Ammonia Solution, Strong SCHEMBL9538468 | 0.42 | ALDH1A1 (0.31) | — | |
| Tetroquinone SCHEMBL167587 | 0.42 | KDM4E (1.00) | — | |
| SCHEMBL31122749 | 0.39 | ALDH1A1 (0.33) | — | |
| SCHEMBL21951588 | 0.36 | — | — | |
| Methane SCHEMBL23044967 | 0.32 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8524891-B2 | Tetraazaporphyrin-based compounds and their uses | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) | 2013-09-03 | — | — | US | disclosed |
| US-20090215105-A1 | Tetraazaporphyrin-Based Compounds and Their Uses | NATIONAL SCIENCE FOUNDATION | 2009-08-27 | — | — | US | disclosed |
| EP-1912921-A2 | TETRAAZAPORPHYRIN-BASED COMPOUNDS AND THEIR USES | Board Of Supervisors Of Louisiana State University And Agricultural And Mechanical College (US) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007009101-A2 | TETRAAZAPORPHYRIN-BASED COMPOUNDS AND THEIR USES | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) | 2007-01-18 | — | — | WO | disclosed |