⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6685509 | 0.73 | — | — | |
| SCHEMBL7081473 | 0.72 | — | — | |
| SCHEMBL6683897 | 0.70 | GAA (0.33) | — | |
| SCHEMBL6683000 | 0.68 | EPHX2 (0.31) | — | |
| SCHEMBL7081797 | 0.68 | GAA (0.37) | — | |
| SCHEMBL7079750 | 0.65 | GAA (0.36) | — | |
| SCHEMBL7079055 | 0.65 | — | — | |
| SCHEMBL1808281 | 0.62 | GRIN2D (0.33) | — | |
| Hydrochloric Acid SCHEMBL7309579 | 0.62 | — | — | |
| SCHEMBL7079808 | 0.61 | GAA (0.43) | — |
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 |