⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL714806 | 0.79 | ALDH1A1 (0.39) | — | |
| SCHEMBL27462239 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL27493568 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL27464845 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL7268119 | 0.75 | HPRT1 (0.44) | — | |
| SCHEMBL27638221 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL27400478 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL27477491 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL6652271 | 0.73 | HTR7 (0.35) | — | |
| SCHEMBL6046805 | 0.72 | ALDH1A1 (0.42) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1315858-A1 | POLYPROPYLENE FIBERS AND FABRICS | Exxonmobil Chemical Patents Inc. (US) | 2003-06-04 | — | — | EP | disclosed |
| EP-1311593-A2 | POLYPROPYLENE FILMS | Exxonmobil Chemical Patents Inc. (US) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002016480-A2 | POLYPROPYLENE FILMS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-02-28 | — | — | WO | disclosed |
| WO-2002016681-A1 | POLYPROPYLENE FIBERS AND FABRICS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-02-28 | — | — | WO | disclosed |