⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8954154 | 0.75 | — | — | |
| SCHEMBL8018737 | 0.70 | — | — | |
| SCHEMBL21731425 | 0.70 | — | — | |
| SCHEMBL8285795 | 0.70 | — | — | |
| SCHEMBL1774204 | 0.70 | — | — | |
| SCHEMBL815291 | 0.70 | — | — | |
| SCHEMBL5433985 | 0.70 | — | — | |
| SCHEMBL13033027 | 0.70 | — | — | |
| SCHEMBL124233 | 0.67 | CRBN (0.36) | — | |
| SCHEMBL1061579 | 0.67 | CRBN (0.36) | — |
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-20060253263-A1 | Method to optimize drug selection, dosing and evaluation and to help predict therapeutic response and toxicity from immunosuppressant therapy | MESHKIN BRIAN J | 2006-11-09 | — | — | US | claimed |
| US-20060253263-A1 | Method to optimize drug selection, dosing and evaluation and to help predict therapeutic response and toxicity from immunosuppressant therapy | MESHKIN BRIAN J | 2006-11-09 | — | — | US | disclosed |