Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STING1 | Q86WV6 | 15/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22200423 | 0.92 | STING1 (0.50) | STING1ACHECTNNB1RAB9A | |
| SCHEMBL22200398 | 0.85 | STING1 (0.57) | STING1SMN1; SMN2CTNNB1 | |
| SCHEMBL21452553 | 0.79 | STING1 (0.56) | STING1ACHE | |
| SCHEMBL21405886 | 0.78 | STING1 (0.79) | STING1ACHE | |
| SCHEMBL22200413 | 0.78 | SMN1; SMN2 (0.45) | SMN1; SMN2ACHEGAANPC1RAB9A | |
| SCHEMBL13662667 | 0.77 | CLK1 (0.50) | SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL22200425 | 0.77 | STING1 (0.57) | STING1CTNNB1 | |
| SCHEMBL21406191 | 0.76 | DYRK1A (0.57) | STING1 | |
| SCHEMBL21405778 | 0.75 | STING1 (0.62) | STING1 | |
| SCHEMBL21405828 | 0.75 | STING1 (0.65) | STING1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-3907221-A1 | FLUORINE-CONTAINING SUBSTITUTED BENZOTHIOPHENE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2021-11-10 | — | — | EP | disclosed |
| WO-2020140894-A1 | FLUORINE-CONTAINING SUBSTITUTED BENZOTHIOPHENE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | 中国科学院上海药物研究所 | 2020-07-09 | — | — | WO | disclosed |