Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 5/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29176876 | 1.00 | S1PR3 (0.46) | S1PR3TDP1NPY2RPTPN1S1PR1 | |
| SCHEMBL30817792 | 0.88 | S1PR3 (0.43) | S1PR3TDP1NPY2RPTPN1S1PR1 | |
| SCHEMBL29176836 | 0.88 | S1PR3 (0.43) | S1PR3TDP1NPY2RPTPN1S1PR1 | |
| SCHEMBL29176864 | 0.87 | S1PR3 (0.46) | S1PR3TDP1PTPN1S1PR1ACACB | |
| SCHEMBL30817773 | 0.87 | S1PR3 (0.46) | S1PR3TDP1PTPN1S1PR1ACACB | |
| SCHEMBL29176830 | 0.84 | AAK1 (0.49) | S1PR3NPY2RPTPN1S1PR1ACACB | |
| SCHEMBL29176858 | 0.84 | L3MBTL1 (0.62) | S1PR3MMP12HTTNPSR1 | |
| SCHEMBL30817778 | 0.84 | L3MBTL1 (0.62) | S1PR3MMP12HTTNPSR1 | |
| SCHEMBL60146 | 0.82 | L3MBTL1 (0.58) | S1PR3TDP1HTTDPP4DPP7 | |
| SCHEMBL30817754 | 0.82 | NR1H4 (0.56) | S1PR3TDP1S1PR1ALDH1A1 |
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-117720535-B | Pyrido [1, 2-a ] pyrimidine mesoionic derivative containing 1,2, 4-oxadiazole structure, and preparation and application thereof | 贵州大学 | 2025-05-13 | — | — | CN | disclosed |
| CN-117720535-A | Pyrido [1,2-a ] pyrimidine mesoionic derivative containing 1,2, 4-oxadiazole structure, and preparation and application thereof | 贵州大学 | 2024-03-19 | — | — | CN | disclosed |