⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5470583 | 1.00 | — | — | |
| SCHEMBL15760 | 1.00 | — | — | |
| SCHEMBL1235699 | 0.97 | TSHR (0.95) | — | |
| SCHEMBL892491 | 0.97 | TSHR (0.95) | — | |
| SCHEMBL362090 | 0.97 | TSHR (0.95) | — | |
| SCHEMBL7185714 | 0.97 | TSHR (0.95) | — | |
| SCHEMBL150736 | 0.97 | TSHR (0.95) | — | |
| SCHEMBL1461668 | 0.97 | TSHR (0.95) | — | |
| Methane SCHEMBL21143001 | 0.97 | TSHR (0.95) | — | |
| Hydrochloric Acid SCHEMBL5166853 | 0.97 | TSHR (0.95) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119080582-A | Recovered components oxo-alcohols and oxo-plasticizers | 伊士曼化工公司 | 2024-12-06 | — | — | CN | disclosed |
| CN-114728868-B | Recovered components oxo-alcohols and oxo-plasticizers | 伊士曼化工公司 | 2024-09-03 | — | — | CN | disclosed |
| EP-4054996-A1 | RECYCLE CONTENT OXO ALCOHOLS & OXO PLASTICIZERS | EASTMAN CHEMICAL COMPANY (US) | 2022-09-14 | — | — | EP | disclosed |
| US-5268252-A | Polyol with o-naphthoquinone-2-diazide-4-sulfonic acid | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-12-07 | — | — | US | disclosed |