Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAP3K14 | Q99558 | 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 | |
|---|---|---|---|---|
| SCHEMBL2485975 | 0.86 | OPRD1 (0.43) | — | |
| SCHEMBL29543994 | 0.86 | OPRD1 (0.43) | — | |
| SCHEMBL11724954 | 0.83 | ESR1 (0.46) | MAP3K14 | |
| SCHEMBL11727963 | 0.82 | PPARG (0.38) | MAP3K14 | |
| SCHEMBL15016506 | 0.81 | ADRA2A (0.56) | ADRA2ATP53MAP3K14 | |
| SCHEMBL23426358 | 0.80 | PIK3CA (0.47) | ADRA2AMAP3K14 | |
| SCHEMBL20856119 | 0.80 | CYP19A1 (0.51) | — | |
| SCHEMBL6479526 | 0.80 | PIK3CA (0.37) | — | |
| SCHEMBL6479522 | 0.80 | PIK3CA (0.37) | — | |
| Methylamine SCHEMBL28010895 | 0.80 | ESR1 (0.43) | MAP3K14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119161354-A | Method for preparing pharmaceutical intermediate chromene [4,3-d ] pyrimidinone derivative and catalytic system | 南京苏亦欣医药科技有限公司 | 2024-12-20 | — | — | CN | disclosed |
| CN-117003761-A | Method for preparing medical intermediate chromene [4,3-d ] pyrimidine dione derivative by using renewable catalytic system | 马鞍山市泰博化工科技有限公司 | 2023-11-07 | — | — | CN | disclosed |