Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL1445658 | 1.00 | PTGS1 (0.30) | PTGS1KCNH2 | |
| SCHEMBL7598022 | 0.88 | THRB (0.33) | — | |
| SCHEMBL4034122 | 0.82 | — | — | |
| SCHEMBL9117823 | 0.81 | GPR84 (0.37) | — | |
| SCHEMBL4820839 | 0.80 | — | — | |
| SCHEMBL4820847 | 0.80 | — | — | |
| SCHEMBL4995784 | 0.79 | CA2 (0.32) | — | |
| SCHEMBL16797539 | 0.79 | — | — | |
| SCHEMBL16797528 | 0.79 | — | — | |
| SCHEMBL16797618 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116655449-A | (R) - (+) -1,2, 4-butanetriol and efficient synthesis method and application thereof | 青岛海药科技有限公司 | 2023-08-29 | — | — | CN | disclosed |