⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13113266 | 0.72 | — | — | |
| SCHEMBL10828134 | 0.67 | — | — | |
| SCHEMBL783100 | 0.67 | — | — | |
| SCHEMBL420160 | 0.65 | — | — | |
| SCHEMBL7880439 | 0.65 | — | — | |
| SCHEMBL10892496 | 0.65 | — | — | |
| SCHEMBL5990888 | 0.65 | — | — | |
| SCHEMBL10613587 | 0.64 | — | — | |
| SCHEMBL18919019 | 0.63 | MEN1 (0.31) | — | |
| SCHEMBL10620246 | 0.61 | ALDH1A1 (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0026609-B1 | AROMATIC POLYESTER AND FILAMENTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-03-21 | — | — | EP | claimed |
| EP-0026609-A1 | Aromatic polyester and filaments | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-04-08 | — | — | EP | claimed |
| US-4232144-A | Polyester which exhibits anisotropy in the melt containing p-oxybenzoyl units and 4-oxy-3'-carbonylbenzophenone units or methyl and chloro derivatives of said units | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-11-04 | — | — | US | claimed |
| EP-0466085-B1 | Thermotropic liquid crystal polyester | KURARAY CO (JP) | 1998-03-11 | — | — | EP | disclosed |
| US-5326848-A | Thermotropic liquid crystal polyester | KURARAY CO., LTD. (JP) | 1994-07-05 | — | — | US | disclosed |
| EP-0466085-A2 | Thermotropic liquid crystal polyester | KURARAY CO., LTD. (JP) | 1992-01-15 | — | — | EP | disclosed |