Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 10/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCND3 | P30281 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7790587 | 1.00 | PTGS2 (0.40) | PTGS2TLR8NFE2L2ERN1CHEK1 | |
| SCHEMBL9419333 | 0.89 | PDE5A (0.38) | PTGS2NFE2L2 | |
| SCHEMBL9419329 | 0.89 | PDE5A (0.38) | PTGS2NFE2L2 | |
| SCHEMBL7530891 | 0.88 | CYSLTR2 (0.40) | PTGS2NFE2L2 | |
| SCHEMBL7530897 | 0.88 | CYSLTR2 (0.40) | PTGS2NFE2L2 | |
| SCHEMBL9419313 | 0.86 | CYSLTR2 (0.42) | PTGS2 | |
| SCHEMBL9419318 | 0.86 | CYSLTR2 (0.42) | PTGS2 | |
| SCHEMBL9419293 | 0.85 | PTGS2 (0.42) | PTGS2NFE2L2ERN1CHEK1CDK4 | |
| SCHEMBL9723201 | 0.85 | PTGS2 (0.42) | PTGS2NFE2L2ERN1CHEK1CDK4 | |
| SCHEMBL20640946 | 0.81 | PTGS2 (0.40) | PTGS2NFE2L2ERN1CHEK1CDK4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1144546-A3 | FLUORINATED TERPHENYLS | QinetiQ Limited (GB) | 2002-08-28 | — | — | EP | disclosed |
| EP-1144546-A2 | FLUORINATED TERPHENYLS | QinetiQ Limited (GB) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000004111-A2 | FLUORINATED TERPHENYLS | THE SECRETARY OF STATE FOR DEFENCE (GB) | 2000-01-27 | — | — | WO | disclosed |
| EP-0363458-B1 | 2,3-DIFLUOROBENZENES | MERCK PATENT GMBH (DE) | 1994-08-03 | — | — | EP | disclosed |
| US-5087764-A | Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile | Merck Patent Gesellschaft mit beschrankter Hafung (DE) | 1992-02-11 | — | — | US | disclosed |