⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16823653 | 0.81 | USP2 (0.33) | — | |
| SCHEMBL5705449 | 0.81 | — | — | |
| SCHEMBL218224 | 0.81 | — | — | |
| SCHEMBL2049920 | 0.79 | — | — | |
| SCHEMBL14629930 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL57322 | 0.77 | — | — | |
| SCHEMBL10643053 | 0.77 | — | — | |
| SCHEMBL1539785 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL10627831 | 0.69 | — | — | |
| SCHEMBL11553851 | 0.69 | — | — |
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-2006044083-A1 | ELASTIC NONWOVEN FABRICS MADE FROM BLENDS OF POLYOLEFINS AND PROCESSES FOR MAKING THE SAME | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-04-27 | — | — | WO | disclosed |