⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1276009 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL23589353 | 0.83 | CYP2D6 (0.33) | — | |
| SCHEMBL10791301 | 0.80 | CYP2D6 (0.39) | — | |
| SCHEMBL11137970 | 0.79 | NFKB1 (0.39) | — | |
| SCHEMBL117317 | 0.78 | — | — | |
| SCHEMBL15837115 | 0.78 | — | — | |
| SCHEMBL10909327 | 0.78 | — | — | |
| SCHEMBL1669837 | 0.78 | CYP2D6 (0.37) | — | |
| SCHEMBL10619203 | 0.78 | — | — | |
| SCHEMBL9194466 | 0.78 | CYP2D6 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7294211-B2 | Non-toxic corrosion-protection conversion coats based on cobalt | UNIVERSITY OF DAYTON (US) | 2007-11-13 | — | — | US | disclosed |
| US-20030234063-A1 | Non-toxic corrosion-protection conversion coats based on cobalt | DAYTON, UNIVERSITY OF | 2003-12-25 | — | — | US | disclosed |