⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL95981 | 0.84 | TP53 (0.47) | — | |
| Ammonia Solution, Strong SCHEMBL8958635 | 0.81 | TP53 (0.44) | — | |
| SCHEMBL11317937 | 0.81 | TP53 (0.44) | — | |
| Hydrogen Sulfide SCHEMBL9001004 | 0.81 | TP53 (0.44) | — | |
| Acetic Acid SCHEMBL6932728 | 0.79 | FFAR3 (0.44) | — | |
| SCHEMBL5086037 | 0.79 | TP53 (0.42) | — | |
| Acetic Acid SCHEMBL20593502 | 0.77 | FFAR3 (0.41) | — | |
| SCHEMBL1641494 | 0.77 | — | — | |
| SCHEMBL8740454 | 0.75 | — | — | |
| SCHEMBL16303293 | 0.74 | TP53 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5164435-A | Polyphenylene ether, alkenyl aromatic resin, heat stability | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1992-11-17 | — | — | US | disclosed |
| EP-0479560-A2 | Stabilized thermoplastic resin composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1992-04-08 | — | — | EP | disclosed |
| US-4687799-A | Compositions of polyphenylene oxide or of mixtures of polyphenylene oxide with a styrene polymer | ENICHEM, S.P.A. (IT) | 1987-08-18 | — | — | US | disclosed |
| EP-0146168-A2 | Compositions of polyphenylene oxide or of mixtures of polyphenylene oxide with a styrene polymer | ENICHEM S.p.A. (IT) | 1985-06-26 | — | — | EP | disclosed |