⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6683895 | 0.82 | GRIN2D (0.30) | — | |
| SCHEMBL7079052 | 0.76 | — | — | |
| SCHEMBL7079747 | 0.76 | POLB (0.31) | — | |
| SCHEMBL7079807 | 0.73 | POLB (0.33) | — | |
| SCHEMBL6831206 | 0.73 | — | — | |
| SCHEMBL3074043 | 0.70 | — | — | |
| SCHEMBL3072421 | 0.70 | POLB (0.33) | — | |
| SCHEMBL3070998 | 0.67 | — | — | |
| SCHEMBL3078173 | 0.67 | ATM (0.36) | — | |
| SCHEMBL4407143 | 0.67 | EPHX2 (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 1 patent. 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 |