⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2058706 | 0.85 | — | — | |
| SCHEMBL8853229 | 0.80 | FAAH (0.30) | — | |
| SCHEMBL9331849 | 0.80 | FAAH (0.30) | — | |
| SCHEMBL8750953 | 0.76 | — | — | |
| SCHEMBL10897397 | 0.74 | — | — | |
| SCHEMBL7033687 | 0.74 | SCN2A (0.32) | — | |
| SCHEMBL7036204 | 0.74 | SCN2A (0.32) | — | |
| SCHEMBL7034735 | 0.74 | SCN2A (0.32) | — | |
| Methane SCHEMBL466565 | 0.73 | SCN2A (0.31) | — | |
| Methane SCHEMBL7033134 | 0.73 | SCN2A (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102166404-B | Multilayer core golf ball | 阿库施耐特公司 | 2016-09-14 | — | — | CN | disclosed |