Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.43 |
| ▸ | ICMT | O60725 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1520186 | 0.86 | KEAP1 (0.68) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL8020393 | 0.85 | CA2 (0.53) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL6599168 | 0.82 | KEAP1 (0.51) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL9314600 | 0.82 | CA2 (0.53) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL8605628 | 0.82 | MTNR1A (0.59) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL28564709 | 0.81 | MTNR1A (0.57) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL31164712 | 0.81 | MTNR1A (0.57) | CA2KEAP1NFE2L2TP53SMN1; SMN2 | |
| SCHEMBL6202916 | 0.81 | KEAP1 (0.75) | CA2KEAP1NFE2L2SMN1; SMN2UTS2R | |
| SCHEMBL28563290 | 0.81 | CYP2A6 (0.64) | CA2KEAP1NFE2L2TP53UTS2R | |
| SCHEMBL19627156 | 0.81 | CA2 (0.49) | CA2KEAP1NFE2L2TP53SMN1; SMN2 |
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-0422119-A4 | BENZOTHIOPHENE DERIVATIVES USEFUL FOR MODIFYING FEEDING BEHAVIOR AND OBSESSIVE-COMPULSIVE BEHAVIOR | — | 1991-11-13 | — | — | EP | disclosed |
| EP-0422119-A1 | BENZOTHIOPHENE DERIVATIVES USEFUL FOR MODIFYING FEEDING BEHAVIOR AND OBSESSIVE-COMPULSIVE BEHAVIOR | NEUREX CORPORATION (US) | 1991-04-17 | — | — | EP | disclosed |
| WO-1989012447-A1 | BENZOTHIOPHENE DERIVATIVES USEFUL FOR MODIFYING FEEDING BEHAVIOR AND OBSESSIVE-COMPULSIVE BEHAVIOR | NEUREX CORPORATION (US) | 1989-12-28 | — | — | WO | disclosed |