⚠ 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 | |
|---|---|---|---|---|
| Methylamine SCHEMBL4361292 | 1.00 | LMNA (0.30) | — | |
| Methylamine SCHEMBL17181787 | 1.00 | LMNA (0.30) | — | |
| Hydrazine SCHEMBL10428013 | 0.82 | LMNA (0.33) | — | |
| Methyl Alcohol SCHEMBL9393721 | 0.82 | TSHR (0.38) | — | |
| SCHEMBL633724 | 0.82 | LMNA (0.43) | — | |
| SCHEMBL3629581 | 0.82 | LMNA (0.43) | — | |
| SCHEMBL25487 | 0.82 | — | — | |
| SCHEMBL16431987 | 0.78 | LMNA (0.30) | — | |
| Ethylamine SCHEMBL11705226 | 0.77 | DNM1 (0.30) | — | |
| Ethylamine SCHEMBL7094676 | 0.77 | DNM1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1996509-A2 | MESOPOROUS ACTIVATED CARBONS | Istvan, Rudyard Lyle (US) | 2008-12-03 | — | — | EP | disclosed |
| WO-2007120386-A2 | MESOPOROUS ACTIVATED CARBONS | ISTVAN RUDYARD LYLE (US) | 2007-10-25 | — | — | WO | disclosed |