⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29506790 | 0.71 | — | — | |
| SCHEMBL195841 | 0.69 | — | — | |
| SCHEMBL4317358 | 0.69 | — | — | |
| SCHEMBL17732197 | 0.67 | — | — | |
| SCHEMBL379483 | 0.67 | — | — | |
| SCHEMBL9650880 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL9649618 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL29417588 | 0.65 | — | — | |
| SCHEMBL17550909 | 0.65 | — | — | |
| SCHEMBL29026357 | 0.63 | — | — |
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-0012440-B1 | METHODS OF PRODUCING LIQUID CRYSTAL DISPLAY CELLS | International Business Machines Corporation (US) | 1983-01-26 | — | — | EP | disclosed |
| US-4261650-A | Method for producing uniform parallel alignment in liquid crystal cells | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 1981-04-14 | — | — | US | disclosed |
| EP-0012440-A1 | Methods of producing liquid crystal display cells | International Business Machines Corporation (US) | 1980-06-25 | — | — | EP | disclosed |