⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11615961 | 0.77 | L3MBTL1 (0.31) | — | |
| SCHEMBL11611984 | 0.74 | DRD2 (0.35) | — | |
| SCHEMBL11613191 | 0.74 | CHRNB2 (0.30) | — | |
| SCHEMBL9862337 | 0.71 | L3MBTL1 (0.32) | — | |
| SCHEMBL5983720 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL14407611 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL19338320 | 0.70 | LMNA (0.30) | — | |
| SCHEMBL11613507 | 0.70 | SIGMAR1 (0.35) | — | |
| SCHEMBL11614086 | 0.70 | CYP1A2 (0.34) | — | |
| SCHEMBL11616246 | 0.69 | CYP1A2 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4118499-A | Anti-anxiety and anti-parkinsonian 1-aminoalkyl-2-endo-chloro-7,7-dimethylnorbornanes | GLAXO LABORATORIES LIMITED (GB) | 1978-10-03 | — | — | US | disclosed |