⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27589740 | 0.84 | — | — | |
| SCHEMBL1366282 | 0.80 | — | — | |
| Dimethylamine SCHEMBL28094804 | 0.80 | TSHR (0.31) | — | |
| SCHEMBL17784252 | 0.77 | — | — | |
| SCHEMBL28903101 | 0.76 | — | — | |
| SCHEMBL107800 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL28416997 | 0.72 | — | — | |
| SCHEMBL138891 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL31087539 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL103898 | 0.71 | LMNA (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006135444-A2 | SLOW-RELEASE INHIBITOR FOR CORROSION CONTROL OF METALS | THE UNIVERSITY OF CINCINNATI (US) | 2006-12-21 | — | — | WO | disclosed |
| WO-2006069376-A2 | IMPROVED SUPERPRIMER | UNIVERSITY OF CINCINNATI (US) | 2006-06-29 | — | — | WO | disclosed |
| US-20060091354-A1 | Slow-release inhibitor for corrosion control of metals | UNIVERSITY OF CINCINNATI | 2006-05-04 | — | — | US | disclosed |