⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8146857 | 0.88 | — | — | |
| SCHEMBL8151579 | 0.85 | KIF11 (0.31) | — | |
| SCHEMBL8147009 | 0.84 | KIF11 (0.31) | — | |
| SCHEMBL8152023 | 0.84 | AR (0.31) | — | |
| SCHEMBL8151715 | 0.83 | KIF11 (0.33) | — | |
| SCHEMBL8151337 | 0.82 | — | — | |
| SCHEMBL8151375 | 0.82 | KDM4E (0.30) | — | |
| SCHEMBL8145407 | 0.82 | — | — | |
| SCHEMBL8146849 | 0.82 | — | — | |
| SCHEMBL8146994 | 0.81 | KIF11 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6103860-A | LOW DIELECTRIC CONSTANT, EXCELLENT TRANSPARENCY, LOW HYGROSCOPICITY AND EXCELLENT PROCESSABILITY; SUBSTRATE FOR AN OPTICAL DISK, A PICK-UP LENS, A PLASTIC SUBSTRATE FOR A LIQUID CELL AND A PRISM | MITSUI CHEMICALS, INC. (JP) | 2000-08-15 | — | — | US | disclosed |
| US-5990261-A | Organic optical component | MITSUI CHEMICALS, INC. (JP) | 1999-11-23 | — | — | US | disclosed |
| EP-0826717-A1 | An organic optical component | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1998-03-04 | — | — | EP | disclosed |