Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 11/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17794275 | 0.91 | BACE1 (0.40) | BACE1BACE2SMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL19731162 | 0.86 | BACE1 (0.45) | BACE1BACE2SMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL7930223 | 0.85 | BACE1 (0.37) | BACE1BACE2SMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL19725852 | 0.84 | BACE1 (0.48) | BACE1BACE2 | |
| SCHEMBL17794133 | 0.82 | BACE1 (0.36) | BACE1BACE2 | |
| SCHEMBL17794122 | 0.78 | BACE1 (0.35) | BACE1BACE2SMN1; SMN2 | |
| SCHEMBL17794130 | 0.76 | BACE1 (0.34) | BACE1BACE2SMN1; SMN2 | |
| SCHEMBL17794149 | 0.76 | BACE1 (0.34) | BACE1BACE2ALDH1A1 | |
| SCHEMBL17794153 | 0.76 | BACE1 (0.48) | BACE1BACE2 | |
| SCHEMBL15466968 | 0.75 | BACE1 (0.34) | BACE1BACE2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170362248-A1 | C5-C6-OXACYCLIC FUSED IMINOPYRIMIDINONE COMPOUNDS AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2017-12-21 | — | — | US | disclosed |
| WO-2016085780-A1 | C5-C6-OXACYCLIC FUSED IMINOPYRIMIDINONE COMPOUNDS AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2016-06-02 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20170362248-A1 | C5-C6-OXACYCLIC FUSED IMINOPYRIMIDINONE COMPOUNDS AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | BACE1, APP, PSEN1 | BACE1 1/4885BACE2 4/4885SMN1; SMN2 302/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.