⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10021186 | 0.83 | ACACB (0.31) | — | |
| SCHEMBL10021049 | 0.83 | L3MBTL1 (0.31) | — | |
| SCHEMBL10021046 | 0.82 | PPARG (0.32) | — | |
| SCHEMBL10021415 | 0.79 | L3MBTL1 (0.33) | — | |
| SCHEMBL9346475 | 0.79 | L3MBTL1 (0.39) | — | |
| SCHEMBL14961053 | 0.76 | PPARG (0.33) | — | |
| SCHEMBL8080646 | 0.75 | KDM1A (0.30) | — | |
| SCHEMBL17997300 | 0.75 | PDE2A (0.36) | — | |
| SCHEMBL8448296 | 0.75 | RIPK1 (0.39) | — | |
| SCHEMBL8448293 | 0.75 | RIPK1 (0.39) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2617701-B1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC CORP (JP) | 2016-07-27 | — | — | EP | disclosed |
| US-8846164-B2 | Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof | JNC CORPORATION (JP) | 2014-09-30 | — | — | US | disclosed |
| US-8846164-B2 | Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof | JNC CORPORATION (JP) | 2014-09-30 | — | — | US | disclosed |
| US-8846164-B2 | Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof | JNC CORPORATION (JP) | 2014-09-30 | — | — | US | disclosed |
| EP-2617701-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC Corporation (JP) | 2013-07-24 | — | — | EP | disclosed |
| US-20130126783-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF | JNC PETROCHEMICAL CORPORATION (JP) | 2013-05-23 | — | — | US | disclosed |
| US-20130126783-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF | JNC PETROCHEMICAL CORPORATION (JP) | 2013-05-23 | — | — | US | disclosed |
| US-20130126783-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF | JNC PETROCHEMICAL CORPORATION (JP) | 2013-05-23 | — | — | US | disclosed |
| WO-2012020643-A1 | COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC株式会社 (JP) | 2012-02-16 | — | — | WO | disclosed |