⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5917693 | 0.82 | ALOX5AP (0.30) | — | |
| SCHEMBL13564246 | 0.81 | — | — | |
| SCHEMBL14476934 | 0.81 | ALOX5AP (0.33) | — | |
| SCHEMBL14982585 | 0.81 | — | — | |
| SCHEMBL14982606 | 0.79 | ALOX5AP (0.32) | — | |
| SCHEMBL13564226 | 0.78 | ALOX5AP (0.31) | — | |
| SCHEMBL13564621 | 0.77 | ALOX5AP (0.33) | — | |
| SCHEMBL12389976 | 0.75 | — | — | |
| SCHEMBL13564244 | 0.75 | ALOX5AP (0.30) | — | |
| SCHEMBL15355118 | 0.75 | ALOX5AP (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050181304-A1 | Method of forming fine pattern | DAIKIN INDUSTRIES, LTD | 2005-08-18 | — | — | US | disclosed |