⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3077084 | 0.86 | — | — | |
| SCHEMBL14868247 | 0.82 | — | — | |
| SCHEMBL2129160 | 0.82 | — | — | |
| SCHEMBL7075603 | 0.78 | — | — | |
| SCHEMBL3178102 | 0.77 | — | — | |
| SCHEMBL14868264 | 0.67 | KDM1A (0.44) | — | |
| SCHEMBL22166727 | 0.66 | — | — | |
| SCHEMBL15100494 | 0.66 | KDM1A (0.37) | — | |
| SCHEMBL14868270 | 0.66 | NOS1 (0.43) | — | |
| SCHEMBL21129307 | 0.66 | — | — |
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-2003060191-A2 | NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT | UNIVERSITY OF DAYTON (US) | 2003-07-24 | — | — | WO | disclosed |