⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3261732 | 0.72 | LMNA (0.35) | — | |
| SCHEMBL220078 | 0.71 | — | — | |
| SCHEMBL8536846 | 0.69 | — | — | |
| SCHEMBL27553125 | 0.69 | — | — | |
| SCHEMBL4233335 | 0.69 | — | — | |
| SCHEMBL157304 | 0.69 | — | — | |
| SCHEMBL11123902 | 0.68 | — | — | |
| SCHEMBL8998334 | 0.68 | — | — | |
| SCHEMBL8896312 | 0.67 | — | — | |
| SCHEMBL18019919 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7416683-B2 | Liquid crystal mixed composition and retardation film using same | NIPPON KAYKU KABUSHIKI KAISHA (JP) | 2008-08-26 | — | — | US | disclosed |
| CN-100345898-C | Liquid crystal compound composition and retardation film using same | NIPPON KAYAKU KK (JP) | 2007-10-31 | — | — | CN | disclosed |
| US-20060060821-A1 | Liquid crystal compound composition and retardation film using same | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2006-03-23 | — | — | US | disclosed |
| CN-1732218-A | Liquid crystal composition and retardation film produced using the same | NIPPON KAYAKU KK (JP) | 2006-02-08 | — | — | CN | disclosed |
| EP-1559745-A1 | LIQUID CRYSTAL COMPOUND COMPOSITION AND RETARDATION FILM USING SAME | Nippon Kayaku Kabushiki Kaisha (JP) | 2005-08-03 | — | — | EP | disclosed |
| US-4769485-A | Preparation of alkenoyl isocyanates | NIPPON PAINT CO., LTD. (JP) | 1988-09-06 | — | — | US | disclosed |