Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.33 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22074018 | 0.77 | PPARG (0.43) | KMT2AMEN1MAPTCYP4F2CYP4A11 | |
| SCHEMBL22077264 | 0.76 | S1PR1 (0.43) | — | |
| SCHEMBL3087127 | 0.72 | NPSR1 (0.43) | MAPTLMNAALDH1A1KDM4EHSD17B10 | |
| SCHEMBL5111929 | 0.64 | KMT2A (0.54) | KMT2AMEN1MAPTCYP4F2CYP4A11 | |
| SCHEMBL5990090 | 0.63 | KDM4E (0.43) | MAPTCYP4F2CYP4A11LMNAALDH1A1 | |
| SCHEMBL6939109 | 0.63 | PTPN1 (0.52) | KMT2AMEN1MAPTCYP4F2CYP4A11 | |
| SCHEMBL13448720 | 0.63 | PTGDR2 (0.54) | KMT2AMEN1CYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL2080801 | 0.62 | CYP4F2 (0.47) | KMT2AMAPTCYP4F2CYP4A11LMNA | |
| SCHEMBL5119177 | 0.61 | ALDH1A1 (0.49) | KMT2AMEN1MAPTCYP4F2CYP4A11 | |
| Ethyl 3-Phenylpropanoate SCHEMBL304816 | 0.60 | TDP1 (0.75) | MAPTCYP4F2CYP4A11ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3892616-A1 | AROMATIC RING DERIVATIVE AS IMMUNOREGULATION AND PREPARATION METHOD AND APPLICATION OF AROMATIC RING DERIVATIVE | Shanghai Jemincare Pharmaceuticals Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |