⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL209943 | 1.00 | — | — | |
| SCHEMBL29016131 | 1.00 | THRB (0.41) | — | |
| SCHEMBL196429 | 1.00 | — | — | |
| SCHEMBL209942 | 1.00 | — | — | |
| SCHEMBL209944 | 1.00 | — | — | |
| SCHEMBL23284422 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28195227 | 0.96 | — | — | |
| SCHEMBL4580880 | 0.87 | FUCA1 (0.39) | — | |
| SCHEMBL846334 | 0.87 | FUCA1 (0.39) | — | |
| Bicarbonate SCHEMBL10392138 | 0.86 | THRB (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014198808-A1 | TETRAAZA-CYCLOPENTA[A]INDENYL DERIVATIVES | ASCENEURON SA (CH) | 2014-12-18 | — | — | WO | disclosed |
| WO-2009126727-A1 | RNA COMPOSITIONS FOR MODULATING IMMUNE RESPONSE | ALNYLAM PHARMACEUTICALS, INC. (US) | 2009-10-15 | — | — | WO | disclosed |