⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2544414 | 0.75 | — | — | |
| SCHEMBL5853434 | 0.75 | — | — | |
| SCHEMBL16897470 | 0.65 | — | — | |
| SCHEMBL8489724 | 0.65 | — | — | |
| SCHEMBL18569918 | 0.60 | — | — | |
| SCHEMBL4190358 | 0.60 | — | — | |
| SCHEMBL6055936 | 0.59 | — | — | |
| SCHEMBL7485721 | 0.55 | — | — | |
| SCHEMBL18806655 | 0.51 | — | — | |
| SCHEMBL4626034 | 0.51 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100063044-A1 | SUBSTITUTED ANILINE DERIVATIVES | H. LUNDBECK A/S (DK) | 2010-03-11 | — | — | US | disclosed |
| US-7601870-B2 | Such as Hexanoic acid (4-bromo-2,6-dimethyl-phenyl)-amide; potassium channel modulators; epilepsy | H. LUNDBECK A/S (DK) | 2009-10-13 | — | — | US | disclosed |