⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1087479 | 0.65 | — | — | |
| SCHEMBL14721453 | 0.60 | — | — | |
| SCHEMBL9242091 | 0.60 | — | — | |
| SCHEMBL727413 | 0.60 | — | — | |
| SCHEMBL584158 | 0.60 | — | — | |
| SCHEMBL4811298 | 0.60 | — | — | |
| SCHEMBL1878158 | 0.60 | — | — | |
| SCHEMBL2983377 | 0.59 | — | — | |
| SCHEMBL1597291 | 0.58 | — | — | |
| SCHEMBL1941602 | 0.58 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0344688-B1 | PROCESS FOR PRODUCING A PHENOLATE AND PROCESS FOR PRODUCING AN AROMATIC POLYETHER KETONE EMPLOYING IT | MITSUBISHI KASEI CORPORATION (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-5171821-A | Azeotropically distilling off water with an organic solvent to obtain the phenolate formed from an alkali compound and a chlorophenylene hydroxyphenylene ketone | MITSUBISHI KASEI CORPORATION (JP) | 1992-12-15 | — | — | US | disclosed |
| EP-0344688-A2 | Process for producing a phenolate and process for producing an aromatic polyether ketone employing it | MITSUBISHI KASEI CORPORATION (JP) | 1989-12-06 | — | — | EP | disclosed |