⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28772553 | 0.75 | — | — | |
| SCHEMBL126328 | 0.75 | — | — | |
| Ethane SCHEMBL28046727 | 0.72 | — | — | |
| SCHEMBL28298061 | 0.72 | — | — | |
| SCHEMBL1644994 | 0.72 | — | — | |
| Sulfuric Acid SCHEMBL30340417 | 0.70 | — | — | |
| SCHEMBL727935 | 0.67 | CA5A (0.46) | — | |
| SCHEMBL9127553 | 0.67 | — | — | |
| SCHEMBL26112598 | 0.67 | CA5A (0.46) | — | |
| Thiosulfuric Acid SCHEMBL27331322 | 0.67 | — | — |
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-20040197293-A1 | Anionic polyurethanes with elastic property | L'OREAL S.A. (FR) | 2004-10-07 | — | — | US | claimed |
| US-20040197293-A1 | Anionic polyurethanes with elastic property | L'OREAL S.A. (FR) | 2004-10-07 | — | — | US | disclosed |