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 | |
|---|---|---|---|---|
| SCHEMBL29804277 | 0.88 | KDM4E (0.32) | KDM4EGAA | |
| SCHEMBL31009227 | 0.77 | HMGCR (0.35) | KDM4EGAA | |
| Methyl Carbamate SCHEMBL29804157 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL29804218 | 0.73 | HMGCR (0.36) | KDM4EGAA | |
| SCHEMBL29804509 | 0.73 | GAA (0.35) | GAA | |
| Acetic Acid SCHEMBL29804101 | 0.71 | HMGCR (0.34) | KDM4EGAA | |
| Fluoroacetate SCHEMBL28206660 | 0.70 | MAOA (0.33) | KDM4EGAA | |
| Acetic Acid SCHEMBL1835057 | 0.70 | FFAR3 (0.39) | GAA | |
| Trifluoroacetic Acid SCHEMBL29880445 | 0.68 | NOS1 (0.35) | — | |
| Trifluoroacetic Acid SCHEMBL28056898 | 0.68 | NOS1 (0.35) | — |
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-114874222-A | Carrying non-aromatic P2 , Novel macrocyclic form of factor XIA | 百时美施贵宝公司 | 2022-08-09 | — | — | CN | disclosed |