⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4600957 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL12389957 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL11042839 | 0.71 | EPHX1 (0.30) | — | |
| SCHEMBL2354252 | 0.71 | SHBG (0.31) | — | |
| Cyclopentane SCHEMBL29058176 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL9158336 | 0.69 | CYP1A2 (0.33) | — | |
| SCHEMBL28418332 | 0.68 | — | — | |
| SCHEMBL729846 | 0.68 | — | — | |
| SCHEMBL9750886 | 0.68 | — | — | |
| SCHEMBL1833029 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5621046-A | BLEND OF HOT OCTANE SOLUBLE AND HOT HEPTANE INSOLUBLE POLYPROPYLENE, ULTRA-HIGH STEREOSPECIFIC POLYPROPYLENE, OLEFINIC RUBBER AND/OR POLYOLEFIN OTHER THAN POLYPROPYLENE; EXCELLENT IMPACT STRENGTH, STIFFNESS AND HEAT RESISTANCE | TONEN CHEMICAL CORPORATION (JP) | 1997-04-15 | — | — | US | disclosed |
| EP-0696616-A2 | Polypropylene resin composition | Tonen Chemical Corporation (JP) | 1996-02-14 | — | — | EP | disclosed |