Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | PSMB1 | P20618 | 7/20 | 0.47 |
| ▸ | PSMB5 | P28074 | 7/20 | 0.47 |
| ▸ | PSMB2 | P49721 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 6/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7108553 | 0.90 | KDM4E (0.49) | KDM4EPSMB1PSMB5PSMB2LTA4H | |
| SCHEMBL3130426 | 0.85 | LTA4H (0.52) | PSMB1PSMB5PSMB2LTA4HPTGS2 | |
| SCHEMBL7777295 | 0.84 | LTA4H (0.53) | PSMB1PSMB5PSMB2LTA4HPTGS2 | |
| SCHEMBL7778580 | 0.79 | LTA4H (0.53) | PSMB1PSMB5PSMB2LTA4HPTGS2 | |
| SCHEMBL7505643 | 0.78 | SMN1; SMN2 (0.47) | KDM4EALDH1A1LTA4HESR1ESR2 | |
| SCHEMBL7918786 | 0.76 | LTA4H (0.47) | KDM4EPSMB1PSMB5PSMB2LTA4H | |
| SCHEMBL13297167 | 0.75 | KDM4E (0.82) | KDM4EPSMB1PSMB5PSMB2ALDH1A1 | |
| SCHEMBL7441879 | 0.75 | TDP1 (0.52) | KDM4EALDH1A1ESR1ESR2 | |
| SCHEMBL7212312 | 0.74 | PSMB1 (0.49) | KDM4EPSMB1PSMB5PSMB2ALDH1A1 | |
| SCHEMBL7466056 | 0.74 | LTA4H (0.61) | KDM4EALDH1A1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| EP-1204656-A2 | A CRYSTALLINE FORM OF 6-HYDROXY-3-(4-[2-(PIPERIDIN-1-YL) ETHOXY] PHENOXY)-2-(4-METHOXYPHENYL) BENZO[B]THIOPHENE HYDROCHLORIDE | ELI LILLY AND COMPANY (US) | 2002-05-15 | — | — | EP | disclosed |
| WO-2001009116-A2 | A NOVEL CRYSTALLINE FORM OF 6-HYDROXY-3- (4-[2-(PIPERIDIN-1-YL) ETHOXY]PHENOXY)- 2-(4-METHOXYPHENYL)BENZO[b]THIOPHENE HYDROCHLORIDE | ELI LILLY AND COMPANY (US) | 2001-02-08 | — | — | WO | disclosed |