⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8973451 | 0.86 | FNTA (0.36) | — | |
| SCHEMBL20863391 | 0.85 | FNTA (0.33) | — | |
| SCHEMBL8973549 | 0.83 | FNTA (0.32) | — | |
| SCHEMBL11022336 | 0.79 | — | — | |
| SCHEMBL8973111 | 0.75 | — | — | |
| SCHEMBL1979236 | 0.68 | CHRNB2 (0.38) | — | |
| SCHEMBL28996412 | 0.67 | — | — | |
| SCHEMBL109285 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL19004724 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL28383696 | 0.65 | TAAR1 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0381149-B1 | Optically active compound, liquid crystal composition and liquid crystal device comprising same | SHARP KK (JP) | 1996-03-27 | — | — | EP | disclosed |
| US-5264152-A | Ferroelectric | SHARP KABUSHIKI KAISHA (JP) | 1993-11-23 | — | — | US | disclosed |
| EP-0381149-A2 | Optically active compound, liquid crystal composition and liquid crystal device comprising same | SHARP KABUSHIKI KAISHA (JP) | 1990-08-08 | — | — | EP | disclosed |