Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 18/20 | 0.84 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18628444 | 1.00 | SMO (0.84) | SMOKMT2ANPSR1PAX8 | |
| SCHEMBL2160744 | 0.92 | SMO (1.00) | SMO | |
| SCHEMBL2160629 | 0.92 | SMO (1.00) | SMO | |
| SCHEMBL2160741 | 0.92 | SMO (1.00) | SMO | |
| SCHEMBL18628438 | 0.91 | SMO (0.80) | SMOKMT2ANPSR1 | |
| SCHEMBL2160672 | 0.89 | SMO (0.88) | SMO | |
| SCHEMBL18628368 | 0.89 | SMO (0.88) | SMOKMT2ANPSR1PAX8 | |
| SCHEMBL18628367 | 0.89 | SMO (0.88) | SMOKMT2ANPSR1PAX8 | |
| SCHEMBL2160674 | 0.89 | SMO (0.88) | SMO | |
| SCHEMBL18628497 | 0.88 | SMO (0.77) | SMOPAX8 |
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-2334683-B1 | SATURATED BICYCLIC HETEROCYCLIC DERIVATIVES AS SMO ANTAGONISTS | MSD ITALIA SRL (IT) | 2017-03-22 | — | — | EP | disclosed |