Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR3 | P51677 | 1/20 | 0.63 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.55 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8550641 | 0.98 | CCR3 (0.61) | CCR3GRIN2BACHEALDH1A1CXCR4 | |
| SCHEMBL7874834 | 0.84 | GRIN2B (0.61) | CCR3GRIN2BACHEALDH1A1CXCR4 | |
| SCHEMBL2665515 | 0.78 | ALDH1A1 (0.50) | GRIN2BALDH1A1GRIN2A | |
| SCHEMBL4433102 | 0.78 | CCR3 (0.73) | CCR3ACHEALDH1A1CXCR4SIGMAR1 | |
| SCHEMBL2004615 | 0.78 | CCR3 (1.00) | CCR3ACHEALDH1A1SIGMAR1KDM4E | |
| SCHEMBL15140944 | 0.78 | CCR3 (0.73) | CCR3ACHEALDH1A1CXCR4SIGMAR1 | |
| SCHEMBL3107807 | 0.76 | CCR3 (0.71) | CCR3ACHEALDH1A1CXCR4SIGMAR1 | |
| SCHEMBL2735346 | 0.76 | CCR3 (0.71) | CCR3ACHEALDH1A1CXCR4SIGMAR1 | |
| SCHEMBL1147100 | 0.76 | CCR3 (0.71) | CCR3ACHEALDH1A1CXCR4SIGMAR1 | |
| SCHEMBL12301255 | 0.76 | CCR3 (0.71) | CCR3ACHEALDH1A1CXCR4SIGMAR1 |
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-0871613-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-21 | — | — | EP | disclosed |
| US-5753679-A | SCIZOPHRENIA | HOFFMANN-LA ROCHE INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1996035666-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 1996-11-14 | — | — | WO | disclosed |