Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL8909261 | 0.90 | RORC (0.33) | RORCTMIGD3ADORA1 | |
| SCHEMBL9094297 | 0.68 | TMIGD3 (0.36) | RORCTMIGD3ADORA1 | |
| SCHEMBL22904608 | 0.67 | MAPT (0.42) | RORCTMIGD3ADORA1 | |
| SCHEMBL12790156 | 0.64 | RORC (0.45) | RORCTMIGD3ADORA1 | |
| SCHEMBL21417547 | 0.63 | MAPT (0.34) | RORC | |
| SCHEMBL5708655 | 0.61 | MAOA (0.47) | — | |
| SCHEMBL24963463 | 0.61 | MAPT (0.39) | TMIGD3ADORA1 | |
| SCHEMBL18674653 | 0.61 | ENPP2 (0.36) | RORC | |
| SCHEMBL21916139 | 0.60 | CCNA2 (0.44) | — | |
| SCHEMBL2227967 | 0.60 | CTSK (0.38) | RORC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5637720-A | Intermediate for (E)-4-[[3-[2-(4-cycloalkyl-2-thiazolyl)ethenyl]phenyl]amino-2,2-alkyldiyl-4-oxobutanoic acids | HOFFMANN-LA ROCHE INC. (US) | 1997-06-10 | — | — | US | disclosed |
| WO-1996008479-A1 | A PROCESS OF MAKING (E)-4-[3-[2-(4-CYCLOALKYL-2-THIAZOLYL)ETHENYL]PHENYL]AMINO-2,2-ALKYLDIYL-4-OXOBUTANOIC ACID | F. HOFFMANN-LA ROCHE AG (CH) | 1996-03-21 | — | — | WO | disclosed |