⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9327448 | 0.87 | — | — | |
| SCHEMBL6305397 | 0.87 | — | — | |
| SCHEMBL31718150 | 0.75 | — | — | |
| Water SCHEMBL22372627 | 0.75 | — | — | |
| SCHEMBL10699656 | 0.75 | — | — | |
| SCHEMBL7777737 | 0.75 | — | — | |
| SCHEMBL11433344 | 0.75 | — | — | |
| SCHEMBL11444383 | 0.75 | — | — | |
| SCHEMBL11444379 | 0.75 | — | — | |
| SCHEMBL8694297 | 0.75 | — | — |
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-4184852-A | Method for making methane from metal carbides | RUSS JAMES J | 1980-01-22 | — | — | US | disclosed |