⚠ 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 | |
|---|---|---|---|---|
| Styrene SCHEMBL4596106 | 0.87 | ALDH1A1 (0.37) | — | |
| SCHEMBL6052120 | 0.81 | — | — | |
| SCHEMBL6932599 | 0.77 | GABRP (0.33) | — | |
| SCHEMBL9507027 | 0.75 | — | — | |
| SCHEMBL1425048 | 0.73 | CYP1A2 (0.41) | — | |
| SCHEMBL28977 | 0.72 | — | — | |
| SCHEMBL8409025 | 0.70 | — | — | |
| Butadiene SCHEMBL7120335 | 0.70 | — | — | |
| SCHEMBL2578374 | 0.70 | — | — | |
| SCHEMBL196269 | 0.69 | CYP3A4 (0.43) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016170143-A1 | METHOD FOR PRODUCING A FIBRE-COMPOSITES BASED ON STYROL- COPOLYMERS | INEOS STYROLUTION GROUP GMBH (DE) | 2016-10-27 | — | — | WO | disclosed |
| EP-2265425-A1 | METHOD AND APPARATUS FOR INJECTION-MOLDING HOLLOW PLASTIC ARTICLES | BASF SE (DE) | 2010-12-29 | — | — | EP | disclosed |
| EP-2219843-A2 | METHOD FOR PRODUCING MOLDED PARTS HAVING REDUCED DEPOSIT FORMATION | BASF SE (DE) | 2010-08-25 | — | — | EP | disclosed |
| WO-2009112387-A1 | METHOD AND APPARATUS FOR INJECTION-MOLDING HOLLOW PLASTIC ARTICLES | BASF SE (DE) | 2009-09-17 | — | — | WO | disclosed |
| WO-2009071537-A2 | METHOD FOR PRODUCING MOLDED PARTS HAVING REDUCED DEPOSIT FORMATION | BASF SE (DE) | 2009-06-11 | — | — | WO | disclosed |