⚠ 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 | |
|---|---|---|---|---|
| Butylamine SCHEMBL34462087 | 1.00 | DNM1 (0.67) | — | |
| Butylamine SCHEMBL332657 | 1.00 | — | — | |
| Butylamine SCHEMBL6473376 | 1.00 | DNM1 (0.67) | — | |
| Butylamine SCHEMBL8142996 | 0.96 | DNM1 (0.62) | — | |
| Butylamine SCHEMBL2051232 | 0.96 | — | — | |
| Butylamine SCHEMBL28735842 | 0.96 | DNM1 (0.62) | — | |
| Butylamine SCHEMBL571241 | 0.96 | — | — | |
| Butylamine SCHEMBL10449621 | 0.96 | — | — | |
| Butylamine SCHEMBL27785480 | 0.96 | DNM1 (0.62) | — | |
| Butylamine SCHEMBL8559 | 0.96 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1540105-A1 | ANTIFUNGAL GYPSUM BOARD | Temple-Inland Forest Products Corporation (US) | 2005-06-15 | — | — | EP | disclosed |
| EP-1421242-A1 | ANTIFUNGAL GYPSUM BOARD | Temple-Inland Forest Products Corporation (US) | 2004-05-26 | — | — | EP | disclosed |
| WO-2004038120-A1 | ANTIFUNGAL GYPSUM BOARD | TEMPLE-INLAND FOREST PRODUCTS CORPORATION (US) | 2004-05-06 | — | — | WO | disclosed |
| WO-2003012218-A1 | ANTIFUNGAL GYPSUM BOARD | TEMPLE-INLAND FOREST PRODUCTS CORPORATION (US) | 2003-02-13 | — | — | WO | disclosed |