⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL546675 | 0.77 | — | — | |
| SCHEMBL17372402 | 0.65 | CYP1A2 (0.34) | — | |
| SCHEMBL17372613 | 0.64 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL14718156 | 0.55 | — | — | |
| SCHEMBL617558 | 0.51 | — | — | |
| SCHEMBL2172011 | 0.51 | — | — | |
| SCHEMBL1604327 | 0.51 | — | — | |
| Butane SCHEMBL15570208 | 0.49 | HDAC1 (0.48) | — | |
| SCHEMBL12799133 | 0.49 | NUDT1 (0.41) | — | |
| SCHEMBL6848363 | 0.46 | HDAC7 (0.39) | — |
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-20180193270-A1 | EXOSOMES FOR DELIVERY OF THERAPEUTIC AGENTS | PURETECH LYT, INC. | 2018-07-12 | — | — | US | disclosed |