⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14304241 | 0.68 | — | — | |
| SCHEMBL10973425 | 0.67 | — | — | |
| SCHEMBL4378090 | 0.67 | — | — | |
| SCHEMBL8812904 | 0.67 | — | — | |
| SCHEMBL9844464 | 0.65 | — | — | |
| SCHEMBL22500166 | 0.64 | — | — | |
| SCHEMBL11376809 | 0.55 | — | — | |
| SCHEMBL2488328 | 0.50 | — | — | |
| SCHEMBL4094369 | 0.50 | — | — | |
| SCHEMBL23803168 | 0.49 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090220707-A1 | LIQUID CRYSTAL ALIGNING AGENT AND LIQUID CRYSTAL DISPLAY DEVICE EMPLOYING IT | NISSAN CHEMICAL INDUSTRIES LIMITED (JP) | 2009-09-03 | — | — | US | disclosed |