⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8693788 | 0.83 | — | — | |
| SCHEMBL11407031 | 0.80 | — | — | |
| SCHEMBL11046871 | 0.76 | — | — | |
| SCHEMBL1826779 | 0.70 | — | — | |
| SCHEMBL11430047 | 0.69 | HTT (0.38) | — | |
| SCHEMBL3738034 | 0.67 | — | — | |
| SCHEMBL11757410 | 0.66 | — | — | |
| SCHEMBL27185995 | 0.66 | — | — | |
| SCHEMBL8983713 | 0.65 | LMNA (0.31) | — | |
| SCHEMBL11054555 | 0.65 | TSHR (0.32) | — |
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-4201725-A | TRISUBSTITUTED METHYL-N-METHYLAMINE, PARKINSON*S DISEASE, ANTISPASMODIC AGENTS | LABAZ (FR) | 1980-05-06 | — | — | US | disclosed |
| US-4057644-A | PARKINSON'S DISEASE | LABAZ (FR) | 1977-11-08 | — | — | US | disclosed |