⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13115437 | 0.76 | — | — | |
| SCHEMBL12835193 | 0.72 | — | — | |
| SCHEMBL19502436 | 0.65 | — | — | |
| SCHEMBL21066929 | 0.65 | — | — | |
| SCHEMBL22476375 | 0.65 | NOS3 (0.31) | — | |
| SCHEMBL20809962 | 0.64 | — | — | |
| SCHEMBL21542490 | 0.62 | — | — | |
| SCHEMBL2958342 | 0.61 | — | — | |
| SCHEMBL10895935 | 0.60 | — | — | |
| SCHEMBL31139280 | 0.59 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2774968-B1 | OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL DEVICE | JNC CORP (JP) | 2019-11-20 | — | — | EP | disclosed |
| EP-2586764-B1 | COMPOUND HAVING BRANCHED ALKYL OR BRANCHED ALKENYL, OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL ELEMENT | JNC CORP (JP) | 2019-09-18 | — | — | EP | disclosed |