⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12191506 | 0.73 | — | — | |
| SCHEMBL2345052 | 0.73 | — | — | |
| SCHEMBL12191508 | 0.73 | — | — | |
| SCHEMBL3149036 | 0.69 | — | — | |
| SCHEMBL12593588 | 0.69 | — | — | |
| SCHEMBL14050172 | 0.69 | — | — | |
| SCHEMBL3797017 | 0.65 | — | — | |
| SCHEMBL22013854 | 0.65 | — | — | |
| SCHEMBL12133368 | 0.65 | — | — | |
| SCHEMBL3003269 | 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 |
|---|---|---|---|---|---|---|---|
| US-20120157402-A1 | METHODS FOR TREATING BRAIN TUMORS | PTC THERAPEUTICS, INC. | 2012-06-21 | — | — | US | disclosed |
| EP-1286682-B1 | METHODS AND COMPOSITIONS FOR INHIBITING IMMUNOGLOBULIN-MEDIATED-REPERFUSION INJURY | IMMUNE DISEASE INST INC (US) | 2010-03-03 | — | — | EP | disclosed |