Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 10/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27541479 | 0.80 | TP53 (0.45) | TP53LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL16886398 | 0.75 | MMP13 (0.50) | LMNAALDH1A1KMT2A | |
| SCHEMBL776396 | 0.73 | LMNA (0.46) | LMNAALDH1A1MEN1KMT2ACYP2C19 | |
| SCHEMBL2625202 | 0.71 | NPC1 (0.47) | LMNAALDH1A1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL19062159 | 0.71 | LMNA (0.45) | LMNAALDH1A1MEN1KMT2ACYP2D6 | |
| SCHEMBL2031617 | 0.71 | LMNA (0.45) | LMNAALDH1A1MEN1KMT2ACYP2C19 | |
| SCHEMBL3648568 | 0.70 | LMNA (0.43) | LMNAALDH1A1MEN1KMT2ACYP2C19 | |
| SCHEMBL5700132 | 0.70 | CCR5 (0.45) | LMNAALDH1A1MEN1KMT2ACYP2C19 | |
| SCHEMBL3025770 | 0.70 | LMNA (0.43) | LMNAALDH1A1MEN1KMT2ACYP2C19 | |
| SCHEMBL3398553 | 0.70 | SRC (0.53) | LMNAALDH1A1MEN1KMT2ACYP2D6 |
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-1694659-B8 | THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORP (US) | 2008-10-08 | — | — | EP | disclosed |
| EP-1697354-A1 | ISOTHIAZOLE DIOXIDES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORPORATION (US) | 2006-09-06 | — | — | EP | disclosed |
| EP-1694659-A1 | THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORPORATION (US) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005068460-A1 | ISOTHIAZOLE DIOXIDES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORPORATION (US) | 2005-07-28 | — | — | WO | disclosed |
| WO-2005066147-A1 | THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORPORATION (US) | 2005-07-21 | — | — | WO | disclosed |