⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL13148759 | 0.87 | BHMT (0.32) | — | |
| SCHEMBL9972817 | 0.80 | — | — | |
| SCHEMBL5590884 | 0.75 | CYP2D6 (0.42) | — | |
| SCHEMBL9972819 | 0.71 | BHMT (0.36) | — | |
| SCHEMBL12764376 | 0.69 | PLA2G4B (0.35) | — | |
| SCHEMBL9889117 | 0.68 | RNPEP (0.33) | — | |
| SCHEMBL215964 | 0.67 | FFAR3 (0.35) | — | |
| SCHEMBL957226 | 0.67 | FFAR3 (0.35) | — | |
| SCHEMBL18412622 | 0.67 | MCL1 (0.35) | — | |
| SCHEMBL2250788 | 0.66 | TDP1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7799561-B2 | Affinity peptides and method for purification of recombinant proteins | SIGMA-ALDRICH, CO. (US) | 2010-09-21 | — | — | US | disclosed |
| US-7741053-B2 | Processes for purification of recombinant proteins | SIGMA-ALDRICH CO. (US) | 2010-06-22 | — | — | US | disclosed |
| US-7709612-B2 | Metal chelating compositions for protein purification, detection or binding | SIGMA-ALDRICH CO. (US) | 2010-05-04 | — | — | US | disclosed |