Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11600499 | 0.84 | TSHR (0.38) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL11226916 | 0.80 | TSHR (0.57) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL7597819 | 0.80 | IDO1 (0.36) | CYP3A4MAPK1 | |
| SCHEMBL11779597 | 0.75 | AHR (0.40) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL6353876 | 0.75 | TSHR (0.52) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL11685824 | 0.75 | TSHR (0.52) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL11548109 | 0.72 | TSHR (0.55) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL28747470 | 0.71 | NOTUM (0.39) | — | |
| SCHEMBL11602077 | 0.69 | CYP3A4 (0.46) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL10493709 | 0.67 | CYP3A4 (0.44) | CYP3A4TSHRMAPK1TDP1 |
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-0077853-B1 | NOVEL TRIFLUOROMETHYL BENZAL CHLORIDES AND PROCESS FOR THE PREPARATION THEREOF | OCCIDENTAL CHEMICAL CORPORATION (US) | 1985-03-13 | — | — | EP | disclosed |
| EP-0077853-A1 | Novel trifluoromethyl benzal chlorides and process for the preparation thereof | OCCIDENTAL CHEMICAL CORPORATION (US) | 1983-05-04 | — | — | EP | disclosed |
| US-4367348-A | Novel trifluoromethyl benzal chlorides and process for the preparation thereof | OCCIDENTAL CHEMICAL CORPORATION (US) | 1983-01-04 | — | — | US | disclosed |