⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20063284 | 0.97 | — | — | |
| SCHEMBL19844684 | 0.95 | CYP1A2 (0.32) | — | |
| SCHEMBL20063289 | 0.93 | TLR4 (0.33) | — | |
| SCHEMBL20063299 | 0.92 | — | — | |
| SCHEMBL17716248 | 0.92 | NOS1 (0.30) | — | |
| SCHEMBL20111062 | 0.92 | CYP1A2 (0.34) | — | |
| SCHEMBL20063281 | 0.88 | — | — | |
| SCHEMBL16789600 | 0.88 | TLR4 (0.31) | — | |
| SCHEMBL20111061 | 0.88 | NOS1 (0.32) | — | |
| SCHEMBL16104446 | 0.87 | CYP1A2 (0.33) | — |
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-20180119011-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF | JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) | 2018-05-03 | — | — | US | disclosed |
| US-20180105747-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF | JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) | 2018-04-19 | — | — | US | disclosed |