⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12217185 | 0.74 | — | — | |
| SCHEMBL3071375 | 0.70 | — | — | |
| SCHEMBL16976546 | 0.65 | — | — | |
| SCHEMBL637104 | 0.64 | — | — | |
| SCHEMBL5255304 | 0.63 | — | — | |
| SCHEMBL2465260 | 0.62 | — | — | |
| SCHEMBL433119 | 0.57 | — | — | |
| SCHEMBL1059686 | 0.57 | — | — | |
| SCHEMBL8335212 | 0.57 | — | — | |
| SCHEMBL851701 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2004269435-A | METHOD FOR PRODUCING BISAMINOMETHYL-1,4-DITHIANE AND INTERMEDIATE THEREFOR | NIPPON SODA CO LTD | 2004-09-30 | — | — | JP | disclosed |