Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | NNMT | P40261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28292626 | 0.86 | KMT2A (0.39) | KMT2AMEN1KIF11PARP10MAPT | |
| SCHEMBL28375297 | 0.86 | KMT2A (0.41) | KMT2AMEN1KIF11PARP10PARP15 | |
| SCHEMBL29273373 | 0.84 | MEN1 (0.54) | KMT2AMEN1PARP10PARP15 | |
| SCHEMBL9519545 | 0.81 | AOC3 (0.39) | KMT2AMEN1KIF11PARP10MAPT | |
| SCHEMBL2904971 | 0.81 | POLB (0.44) | KMT2AMEN1MAPT | |
| SCHEMBL26640548 | 0.79 | SYK (0.39) | KMT2AMEN1KIF11PARP10MAPT | |
| SCHEMBL28292573 | 0.79 | KIF11 (0.36) | KMT2AMEN1KIF11PARP10MAPT | |
| SCHEMBL5568443 | 0.78 | RAB9A (0.56) | KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL28286228 | 0.78 | KMT2A (0.49) | KMT2AMEN1KIF11PARP10PARP15 | |
| SCHEMBL27691370 | 0.77 | NNMT (0.53) | KMT2AMEN1KIF11NNMTSMN1; SMN2 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116554092-A | Method for preparing new drug building block (6-formylpyridin-3-yl) carbamic acid tert-butyl ester | 上海锐谱医药科技有限公司 | 2023-08-08 | — | — | CN | claimed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | claimed |
| CN-118119626-A | Fused bicyclic heteroaryl compounds useful as NLRP3 inhibitors | 豪夫迈·罗氏有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-116554092-A | Method for preparing new drug building block (6-formylpyridin-3-yl) carbamic acid tert-butyl ester | 上海锐谱医药科技有限公司 | 2023-08-08 | — | — | CN | disclosed |
| CN-116554092-A | Method for preparing new drug building block (6-formylpyridin-3-yl) carbamic acid tert-butyl ester | 上海锐谱医药科技有限公司 | 2023-08-08 | — | — | CN | disclosed |
| WO-2023066825-A1 | FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-04-27 | — | — | WO | disclosed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| CN-110770224-B | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-110770224-A | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2020-02-07 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-104394869-A | Substituted bicyclic aza-heterocycles and analogues as sirtuin modulators | GLAXOSMITHKLINE LLC | 2015-03-04 | — | — | CN | disclosed |