⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6683797 | 0.81 | GAA (0.33) | — | |
| SCHEMBL3074046 | 0.79 | — | — | |
| SCHEMBL7079055 | 0.75 | — | — | |
| SCHEMBL7081589 | 0.75 | GAA (0.36) | — | |
| SCHEMBL3074100 | 0.73 | — | — | |
| SCHEMBL3087150 | 0.73 | — | — | |
| SCHEMBL6831209 | 0.71 | GAA (0.33) | — | |
| SCHEMBL3077018 | 0.71 | GAA (0.33) | — | |
| SCHEMBL3066008 | 0.70 | GAA (0.32) | — | |
| SCHEMBL3067714 | 0.70 | GAA (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004065305-A1 | NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE | UNIVERSITY OF DAYTON (US) | 2004-08-05 | — | — | WO | disclosed |
| WO-2003060191-A2 | NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |