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 | |
|---|---|---|---|---|
| SCHEMBL26954334 | 0.79 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL23665511 | 0.77 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL20257469 | 0.76 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL23259368 | 0.75 | MAPK1 (0.31) | — | |
| SCHEMBL5907157 | 0.74 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL19956515 | 0.74 | — | — | |
| SCHEMBL14607625 | 0.74 | TSHR (0.31) | ALDH1A1 | |
| SCHEMBL24355618 | 0.72 | — | — | |
| SCHEMBL27270880 | 0.72 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL12146174 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023177563-A2 | FUSED PYRAZOLE AMIDE ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | MERCK SHARP & DOHME LLC (US) | 2023-09-21 | — | — | WO | disclosed |
| WO-2022115301-A1 | MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2022-06-02 | — | — | WO | disclosed |