Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8955219 | 0.80 | CA12 (0.35) | CYP3A4CYP2C19SLC6A4ALDH1A1KDM4E | |
| SCHEMBL9129250 | 0.77 | SLC6A2 (0.46) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL17011305 | 0.77 | SLC6A2 (0.46) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL12784512 | 0.77 | SLC6A2 (0.46) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8349612 | 0.75 | CYP3A4 (0.43) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6632699 | 0.75 | CYP3A4 (0.43) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL623356 | 0.73 | PTGS2 (0.44) | CYP3A4CYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL26689 | 0.72 | KMT2A (0.44) | KMT2AMEN1MAPTLMNASMN1; SMN2 | |
| SCHEMBL21162070 | 0.72 | TSHR (0.34) | CYP3A4CYP17A1ALDH1A1 | |
| SCHEMBL15350067 | 0.72 | TSHR (0.34) | CYP3A4CYP17A1ALDH1A1 |
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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112661694-B | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2023-04-11 | — | — | CN | claimed |
| CN-112661694-A | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2021-04-16 | — | — | CN | claimed |
| CN-102344440-B | Anticoccidial compound for livestock and poultry and preparation method thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2013-10-30 | — | — | CN | claimed |
| CN-102408413-B | Anticoccidial compound, and preparation method and use thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2013-08-14 | — | — | CN | claimed |
| CN-102311425-B | Anticoccidiosis compound and preparation method as well as application thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2013-06-05 | — | — | CN | claimed |
| CN-102408413-A | Anticoccidial compound and preparation method and application thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2012-04-11 | — | — | CN | claimed |
| CN-102344440-A | Anticoccidial compound for livestock and poultry and preparation method thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2012-02-08 | — | — | CN | claimed |
| CN-102311425-A | Anticoccidiosis compound and preparation method as well as application thereof | CHINA ANIMAL HUSBANDRY INDUSTRY CO LTD | 2012-01-11 | — | — | CN | claimed |
| WO-2024063576-A1 | NOVEL QUINAZOLINE COMPOUND AS KRAS INHIBITOR | 일동제약(주) | 2024-03-28 | — | — | WO | disclosed |
| CN-112661694-B | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2023-04-11 | — | — | CN | disclosed |
| CN-112661694-B | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2023-04-11 | — | — | CN | disclosed |
| CN-112661694-A | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-112661694-A | Preparation method of 4- (dimethoxymethyl) -piperidine | 西安凯立新材料股份有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-107667092-A | Formylated N Hete rocyclic derivatives as FGFR4 inhibitor | 诺华股份有限公司 | 2018-02-06 | — | — | CN | disclosed |
| EP-0854870-A1 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | Merck & Co., Inc. (US) | 1998-07-29 | — | — | EP | disclosed |
| US-5776954-A | GLUCAGON ANTAGONISTS | MERCK & CO., INC. (US) | 1998-07-07 | — | — | US | disclosed |
| US-5717100-A | Substituted imidazoles having anti-cancer and cytokine inhibitory activity | MERCK & CO., INC. (US) | 1998-02-10 | — | — | US | disclosed |
| WO-1997012876-A9 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | — | 1997-09-18 | — | — | WO | disclosed |
| WO-1997016442-A1 | SUBSTITUTED PYRIDYL PYRROLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK & CO., INC. (US) | 1997-05-09 | — | — | WO | disclosed |
| WO-1997012876-A1 | SUBSTITUTED IMIDAZOLES HAVING ANTI-CANCER AND CYTOKINE INHIBITORY ACTIVITY | MERCK & CO., INC. (US) | 1997-04-10 | — | — | WO | disclosed |