⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10874823 | 0.73 | ALDH1A1 (0.36) | — | |
| SCHEMBL5482404 | 0.73 | — | — | |
| SCHEMBL5028821 | 0.70 | TSHR (0.41) | — | |
| SCHEMBL2030787 | 0.69 | — | — | |
| SCHEMBL3789692 | 0.68 | — | — | |
| SCHEMBL15270498 | 0.67 | — | — | |
| SCHEMBL8837318 | 0.67 | — | — | |
| SCHEMBL8204516 | 0.66 | — | — | |
| SCHEMBL2025448 | 0.66 | — | — | |
| SCHEMBL16115512 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102821804-B | Medical device with slideable coating, and syringe | TERUMO CORP | 2015-06-10 | — | — | CN | disclosed |
| CN-102821804-A | Medical device with slideable coating, and syringe | TERUMO CORP | 2012-12-12 | — | — | CN | disclosed |