⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6832603 | 0.75 | — | — | |
| SCHEMBL468321 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL7159145 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL6309115 | 0.62 | — | — | |
| SCHEMBL3672456 | 0.62 | ALDH1A1 (0.33) | — | |
| SCHEMBL5366234 | 0.62 | — | — | |
| SCHEMBL3286940 | 0.62 | — | — | |
| SCHEMBL15733208 | 0.61 | — | — | |
| SCHEMBL5413717 | 0.60 | — | — | |
| SCHEMBL16675025 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1472319-A1 | NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003060019-A1 | NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |