⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5137103 | 0.85 | — | — | |
| SCHEMBL5496994 | 0.85 | HTR2C (0.45) | — | |
| SCHEMBL6682800 | 0.85 | HTR2C (0.50) | — | |
| Hydrochloric Acid SCHEMBL28234487 | 0.82 | HTR2C (0.44) | — | |
| SCHEMBL8922161 | 0.80 | CYP1A2 (0.55) | — | |
| Hydrochloric Acid SCHEMBL11847967 | 0.80 | HTR2C (0.52) | — | |
| SCHEMBL93781 | 0.80 | — | — | |
| SCHEMBL3121478 | 0.79 | GLRA1 (0.39) | — | |
| SCHEMBL8923849 | 0.79 | CYP1A2 (0.48) | — | |
| SCHEMBL18249514 | 0.78 | HTR2C (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002053616-A1 | NEW LINEAR BLOCK POLYMER | ARTIMPLANT AB (SE) | 2002-07-11 | — | — | WO | disclosed |