⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19844888 | 0.69 | — | — | |
| SCHEMBL1521909 | 0.69 | — | — | |
| SCHEMBL30106458 | 0.69 | — | — | |
| SCHEMBL12120896 | 0.67 | MAPT (0.44) | — | |
| SCHEMBL15994843 | 0.65 | — | — | |
| SCHEMBL17366245 | 0.65 | — | — | |
| SCHEMBL5968576 | 0.65 | — | — | |
| SCHEMBL1044788 | 0.65 | — | — | |
| SCHEMBL1445722 | 0.65 | — | — | |
| SCHEMBL7861822 | 0.64 | CRHBP (0.30) | — |
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-8466167-B2 | Compounds and compositions as TLR activity modulators | IRM LLC (BM) | 2013-06-18 | — | — | US | disclosed |
| US-20110081365-A1 | COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS | IRM LLC (BM) | 2011-04-07 | — | — | US | disclosed |