⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8517559 | 0.83 | — | — | |
| SCHEMBL2355024 | 0.62 | — | — | |
| SCHEMBL16421296 | 0.60 | — | — | |
| SCHEMBL3519716 | 0.60 | — | — | |
| SCHEMBL62712 | 0.60 | — | — | |
| SCHEMBL8579642 | 0.60 | TSHR (0.33) | — | |
| SCHEMBL2108448 | 0.60 | — | — | |
| SCHEMBL1371573 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL14812662 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL9815371 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1230207-B1 | METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS | PEDERSON RICHARD L (US) | 2005-06-22 | — | — | EP | claimed |