⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28212374 | 0.79 | ALOX5 (0.33) | — | |
| SCHEMBL11251020 | 0.73 | TDP1 (0.32) | — | |
| SCHEMBL11878198 | 0.70 | TP53 (0.33) | — | |
| SCHEMBL6683594 | 0.70 | TDP1 (0.32) | — | |
| SCHEMBL3071394 | 0.70 | CRBN (0.37) | — | |
| SCHEMBL6686110 | 0.69 | ALOX5 (0.33) | — | |
| SCHEMBL10905720 | 0.67 | — | — | |
| SCHEMBL7078801 | 0.65 | ALOX5 (0.34) | — | |
| SCHEMBL7080003 | 0.65 | — | — | |
| SCHEMBL6686103 | 0.63 | ALOX5 (0.31) | — |
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 |