Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 15/20 | 1.00 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27806711 | 0.82 | CCR4 (1.00) | CCR4 | |
| SCHEMBL179796 | 0.78 | CCR4 (0.64) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL29527262 | 0.78 | CCR4 (0.64) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL10881037 | 0.78 | CCR4 (0.62) | CCR4KDM4EALDH1A1HTTGLA | |
| SCHEMBL14160791 | 0.76 | CCR4 (0.61) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL21457065 | 0.73 | CCR4 (0.56) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL21457084 | 0.69 | CCR4 (0.53) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL194522 | 0.69 | MAOA (0.61) | CCR4MAOAKDM4EALDH1A1MEN1 | |
| SCHEMBL4955063 | 0.69 | CCR4 (0.52) | CCR4KDM4EALDH1A1HTTMEN1 | |
| SCHEMBL10001285 | 0.68 | ALDH1A1 (0.54) | CCR4KDM4EALDH1A1HTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102050809-B | Chemokine-like factor 1 (CKLF1)/C chemokine receptor 4 (CCR4) interaction-antagonistic 3-peperazinyl coumarin derivatives | INST MATERIA MEDICA CAMS | 2014-12-17 | — | — | CN | disclosed |
| CN-103446154-A | Applications of coumarin derivatives in preventing and curing serious brain diseases | INST MATERIA MEDICA CAMS | 2013-12-18 | — | — | CN | disclosed |
| CN-102050809-A | Chemokine-like factor 1 (CKLF1)/C chemokine receptor 4 (CCR4) interaction-antagonistic 3-peperazinyl coumarin derivatives | INST MATERIA MEDICA CAMS | 2011-05-11 | — | — | CN | disclosed |