⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28521049 | 0.92 | DPP4 (0.36) | — | |
| SCHEMBL9104933 | 0.90 | AGER (0.38) | — | |
| SCHEMBL4442911 | 0.88 | AGER (0.41) | — | |
| SCHEMBL16653682 | 0.88 | AGER (0.41) | — | |
| SCHEMBL3742090 | 0.84 | CYP2D6 (0.32) | — | |
| SCHEMBL5033685 | 0.83 | C5AR1 (0.32) | — | |
| SCHEMBL3727776 | 0.82 | — | — | |
| SCHEMBL1439179 | 0.80 | ADORA2A (0.37) | — | |
| SCHEMBL22341312 | 0.77 | — | — | |
| SCHEMBL967470 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2549990-A1 | COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. | IRM LLC (BM) | 2013-01-30 | — | — | EP | disclosed |
| WO-2011119759-A1 | COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. | IRM LLC (BM) | 2011-09-29 | — | — | WO | disclosed |