⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10397646 | 0.87 | — | — | |
| SCHEMBL9788071 | 0.85 | — | — | |
| Ethane SCHEMBL5052383 | 0.80 | — | — | |
| SCHEMBL4515432 | 0.80 | — | — | |
| SCHEMBL3919064 | 0.80 | — | — | |
| Methane SCHEMBL19915300 | 0.80 | — | — | |
| Ammonia Solution, Strong SCHEMBL10633588 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL3442942 | 0.80 | — | — | |
| Water SCHEMBL639453 | 0.80 | — | — | |
| SCHEMBL3909292 | 0.80 | — | — |
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-5567764-A | CONTAINING AT LEAST ONE ORGANOHYDROGENSILICON COMPOUND AND A PLATINUM GROUP METAL-CONTAINING CATALYST | DOW CORNING CORPORATION (US) | 1996-10-22 | — | — | US | disclosed |