Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.62 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.58 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28926070 | 0.89 | S1PR1 (0.59) | S1PR1S1PR3S1PR5 | |
| SCHEMBL28636073 | 0.89 | S1PR1 (0.59) | S1PR1S1PR3S1PR5 | |
| SCHEMBL28633912 | 0.84 | S1PR1 (0.59) | S1PR1S1PR3 | |
| SCHEMBL6113696 | 0.83 | S1PR1 (0.56) | S1PR1S1PR3S1PR5KCNH2 | |
| Hydrochloric Acid SCHEMBL28652284 | 0.81 | S1PR1 (0.59) | S1PR1S1PR3S1PR5 | |
| Hydrochloric Acid SCHEMBL28640825 | 0.81 | S1PR1 (0.66) | S1PR1S1PR3S1PR5 | |
| Hydrochloric Acid SCHEMBL28631882 | 0.80 | S1PR1 (0.58) | S1PR1S1PR3S1PR5KCNH2 | |
| SCHEMBL28633863 | 0.80 | S1PR1 (0.58) | S1PR1S1PR3S1PR5 | |
| SCHEMBL2132920 | 0.80 | S1PR1 (0.62) | S1PR1S1PR3S1PR5KCNH2 | |
| SCHEMBL2131514 | 0.80 | S1PR1 (0.65) | S1PR1S1PR3S1PR5KCNH2 |
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-109956912-B | Carboxylic acid compound containing diphenyl oxadiazole, preparation method and medical application thereof | 中国医学科学院药物研究所 | 2021-10-22 | — | — | CN | disclosed |
| CN-107827837-B | Sphingosine-1-phosphate receptor modulator compounds, and preparation method and application thereof | 苏州朗科生物技术股份有限公司 | 2021-09-24 | — | — | CN | disclosed |