⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13073778 | 1.00 | — | — | |
| SCHEMBL4267030 | 1.00 | — | — | |
| SCHEMBL18556498 | 0.83 | ALDH1A1 (0.35) | — | |
| SCHEMBL24080860 | 0.82 | — | — | |
| SCHEMBL14472645 | 0.82 | — | — | |
| SCHEMBL4273508 | 0.82 | — | — | |
| SCHEMBL14207168 | 0.80 | — | — | |
| SCHEMBL14040440 | 0.80 | CA2 (0.31) | — | |
| SCHEMBL8003727 | 0.78 | OPRM1 (0.44) | — | |
| SCHEMBL12652162 | 0.78 | OPRM1 (0.44) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9768133-B1 | Semiconductor package and method of forming the same | TAIWAN SEMICONDUCTOR MANUFACTURING COMPANY, LTD. (TW) | 2017-09-19 | — | — | US | disclosed |
| EP-2571871-B1 | Process for the preparation of chiral triazolones | SANDOZ AG (CH) | 2017-06-21 | — | — | EP | disclosed |
| US-20070031335-A1 | Nucleic acids and corresponding proteins useful in the detection and treatment of various cancers | AGENSYS, INC. | 2007-02-08 | — | — | US | disclosed |