⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13191951 | 1.00 | — | — | |
| SCHEMBL10714185 | 0.87 | — | — | |
| SCHEMBL14616168 | 0.87 | — | — | |
| SCHEMBL13406437 | 0.87 | — | — | |
| SCHEMBL10714191 | 0.87 | — | — | |
| SCHEMBL14849656 | 0.81 | — | — | |
| SCHEMBL9245481 | 0.76 | LMNA (0.63) | — | |
| SCHEMBL22504420 | 0.76 | GRIK1 (0.30) | — | |
| SCHEMBL24001783 | 0.74 | — | — | |
| SCHEMBL11895908 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5238602-A | Electrooptical cells | HOFFMANN LA ROCHE INC. (US) | 1993-08-24 | — | — | US | disclosed |
| EP-0168683-B1 | LIQUID CRYSTALS WITH ALKENYL OR ALKENYLOXY GROUPS | F. HOFFMANN-LA ROCHE AG (CH) | 1990-11-28 | — | — | EP | disclosed |