⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19940053 | 0.82 | — | — | |
| SCHEMBL21561701 | 0.79 | — | — | |
| SCHEMBL12950636 | 0.79 | — | — | |
| SCHEMBL13953726 | 0.79 | AMY1A (0.40) | — | |
| SCHEMBL12149515 | 0.78 | LGALS8 (0.31) | — | |
| SCHEMBL10311018 | 0.75 | — | — | |
| SCHEMBL17052659 | 0.75 | TLR4 (0.36) | — | |
| SCHEMBL25976118 | 0.75 | TLR4 (0.36) | — | |
| SCHEMBL12154024 | 0.73 | LGALS8 (0.30) | — | |
| SCHEMBL13633940 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180064745-A1 | COMPOSITIONS AND METHODS FOR ACTIVATING \"STIMULATOR OF INTERFERON GENE\" - DEPENDENT SIGNALLING | Aduro Biotech, Inc. (US) | 2018-03-08 | — | — | US | disclosed |