⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5201096 | 0.78 | — | — | |
| SCHEMBL7753464 | 0.77 | — | — | |
| SCHEMBL10777180 | 0.75 | — | — | |
| SCHEMBL28487545 | 0.75 | — | — | |
| Ethane SCHEMBL4755795 | 0.75 | — | — | |
| SCHEMBL6663829 | 0.73 | TP53 (0.47) | — | |
| SCHEMBL447234 | 0.73 | TP53 (0.47) | — | |
| SCHEMBL6910170 | 0.73 | — | — | |
| SCHEMBL371443 | 0.71 | TP53 (0.44) | — | |
| SCHEMBL27382 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5157876-A | Using a mixture of water, colloidal silica and bleach including sodium hypochlorite; controlling time and pressure | ROCKWELL INTERNATIONAL CORPORATION (US) | 1992-10-27 | — | — | US | disclosed |
| US-5137544-A | Mixture of water, colloidal silica and bleach containing sodium hypochlorite | ROCKWELL INTERNATIONAL CORPORATION (US) | 1992-08-11 | — | — | US | disclosed |