Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20420713 | 0.75 | PTGS2 (0.46) | PTGS2 | |
| SCHEMBL20420774 | 0.73 | PTGS2 (0.44) | PTGS2NQO1CA12CA1CA9 | |
| SCHEMBL5396825 | 0.65 | NQO1 (0.67) | NQO1CA12CA1CA9 | |
| SCHEMBL29886946 | 0.65 | PTGS2 (0.53) | PTGS2 | |
| SCHEMBL29182638 | 0.63 | CA9 (0.64) | NQO1CA12CA1CA9 | |
| SCHEMBL31264770 | 0.63 | CA9 (0.68) | NQO1CA12CA1CA9 | |
| SCHEMBL516275 | 0.63 | CA9 (0.68) | NQO1CA12CA1CA9 | |
| SCHEMBL1181618 | 0.61 | CA12 (0.69) | CA12CA1CA9 | |
| SCHEMBL9845372 | 0.61 | GABRP (0.58) | NQO1CA12CA1CA9 | |
| SCHEMBL13236780 | 0.61 | NOD2 (0.68) | CA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3354648-A1 | 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF | Guizhou Bailing Group Pharmaceutical Co., Ltd. (CN) | 2018-08-01 | — | — | EP | disclosed |