Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL11547476 | 0.83 | ALDH1A1 (0.42) | ALDH1A1THRB | |
| SCHEMBL2887903 | 0.81 | THRB (0.41) | ALDH1A1THRB | |
| SCHEMBL236894 | 0.81 | ALDH1A1 (0.41) | ALDH1A1THRB | |
| SCHEMBL31512502 | 0.81 | THRB (0.41) | ALDH1A1THRB | |
| SCHEMBL20561093 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB | |
| SCHEMBL21065620 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB | |
| SCHEMBL10340015 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB | |
| SCHEMBL22142472 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB | |
| SCHEMBL10635788 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB | |
| Methane SCHEMBL21065618 | 0.79 | ALDH1A1 (0.40) | ALDH1A1THRB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5051527-A | Liquid crystal compounds having fluoroalkyl radical | SHOWA SHELL SEKIYU K.K. (JP) | 1991-09-24 | — | — | US | claimed |
| EP-0331367-A2 | Liquid crystal compounds having fluoroalkyl radical | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1989-09-06 | — | — | EP | claimed |
| EP-0331367-B1 | Liquid crystal compounds having fluoroalkyl radical | SHOWA SHELL SEKIYU (JP) | 1993-12-08 | — | — | EP | disclosed |
| EP-0331367-A2 | Liquid crystal compounds having fluoroalkyl radical | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1989-09-06 | — | — | EP | disclosed |