Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16758990 | 0.83 | IDO1 (0.58) | IDO1P2RX7 | |
| SCHEMBL10970057 | 0.83 | IDO1 (0.41) | IDO1TSHR | |
| SCHEMBL17414236 | 0.82 | KLF10 (0.40) | IDO1TSHRP2RX7 | |
| SCHEMBL10972764 | 0.77 | TSHR (0.58) | IDO1TSHR | |
| SCHEMBL10969471 | 0.75 | TSHR (0.40) | TSHR | |
| SCHEMBL9576388 | 0.75 | TSHR (0.48) | IDO1TSHR | |
| SCHEMBL20560697 | 0.74 | IDO1 (0.33) | IDO1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL2708686 | 0.73 | PSEN1 (0.47) | IDO1ALDH1A1 | |
| SCHEMBL10451789 | 0.73 | MEN1 (0.43) | IDO1ALDH1A1CYP1A2CYP2C9HPGD | |
| SCHEMBL10976219 | 0.72 | TSHR (0.58) | IDO1TSHRCYP1A2CYP2C9CYP2C19 |
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 |