Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL333490 | 0.75 | — | — | |
| SCHEMBL1032820 | 0.74 | MCL1 (0.50) | MCL1KDM4EMAPT | |
| SCHEMBL28504677 | 0.74 | MCL1 (0.44) | MCL1KDM4EMEN1LMNAMAPT | |
| SCHEMBL9362533 | 0.73 | MCL1 (0.48) | MCL1KDM4EMEN1LMNAMAPT | |
| SCHEMBL11351147 | 0.72 | MEN1 (0.44) | MCL1MEN1LMNAKMT2A | |
| SCHEMBL28850955 | 0.70 | — | — | |
| SCHEMBL27290461 | 0.70 | — | — | |
| SCHEMBL9653268 | 0.70 | — | — | |
| Bromide SCHEMBL27567305 | 0.69 | ALOX15 (0.31) | — | |
| SCHEMBL15492524 | 0.69 | — | — |
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-119039294-B | Preparation method of 3, 7-dimethyl xanthine | 石药创新制药股份有限公司 | 2025-03-11 | — | — | CN | claimed |
| CN-119039294-A | Preparation method of 3, 7-dimethyl xanthine | 石药创新制药股份有限公司 | 2024-11-29 | — | — | CN | claimed |
| CN-112142738-A | Preparation method of theobromine | 石药集团新诺威制药股份有限公司 | 2020-12-29 | — | — | CN | claimed |
| CN-119039294-B | Preparation method of 3, 7-dimethyl xanthine | 石药创新制药股份有限公司 | 2025-03-11 | — | — | CN | disclosed |
| CN-119039294-A | Preparation method of 3, 7-dimethyl xanthine | 石药创新制药股份有限公司 | 2024-11-29 | — | — | CN | disclosed |
| CN-114213342-A | Production system and method for preparing 6-amino-1,3-dimethyl uracil | 青岛科技大学 | 2022-03-22 | — | — | CN | disclosed |
| CN-114213342-A | Production system and method for preparing 6-amino-1,3-dimethyl uracil | 青岛科技大学 | 2022-03-22 | — | — | CN | disclosed |
| CN-112142738-A | Preparation method of theobromine | 石药集团新诺威制药股份有限公司 | 2020-12-29 | — | — | CN | disclosed |
| CN-112142738-A | Preparation method of theobromine | 石药集团新诺威制药股份有限公司 | 2020-12-29 | — | — | CN | disclosed |
| CN-102329317-B | Method for synthesizing theobromine | SHIJIAZHUANG PHARMACEUTICAL INVOVATION CO LTD | 2013-06-05 | — | — | CN | disclosed |
| JP-2001151761-A | METHOD FOR PRODUCING URACIL OF THYMINE | MITSUI CHEMICALS INC | 2001-06-05 | — | — | JP | disclosed |