⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL477706 | 0.89 | — | — | |
| SCHEMBL24570 | 0.89 | — | — | |
| SCHEMBL477853 | 0.89 | — | — | |
| Potassium SCHEMBL29657066 | 0.85 | — | — | |
| SCHEMBL29657081 | 0.85 | — | — | |
| Lithium SCHEMBL29657113 | 0.85 | — | — | |
| SCHEMBL8108432 | 0.76 | TSHR (0.39) | — | |
| Lindane SCHEMBL9806015 | 0.73 | TSHR (0.42) | — | |
| Hexane SCHEMBL17394507 | 0.73 | TSHR (0.44) | — | |
| SCHEMBL8108425 | 0.71 | TSHR (0.35) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1670446-A2 | METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION | JAPAN TOBACCO INC. (JP) | 2006-06-21 | — | — | EP | claimed |
| WO-2005030185-A2 | METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION | JAPAN TOBACCO INC. (JP) | 2005-04-07 | — | — | WO | claimed |
| CN-105408328-A | sGC stimulators | IRONWOOD PHARMACEUTICALS INC | 2016-03-16 | — | — | CN | disclosed |