⚠ 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL5974518 | 0.86 | — | — | |
| Bicarbonate SCHEMBL28502389 | 0.86 | LMNA (0.54) | — | |
| Formic Acid SCHEMBL1706338 | 0.82 | LMNA (0.40) | — | |
| Bicarbonate SCHEMBL28856447 | 0.82 | — | — | |
| Formic Acid SCHEMBL28274231 | 0.82 | — | — | |
| SCHEMBL2414 | 0.80 | — | — | |
| Hydrogen Peroxide SCHEMBL4368249 | 0.80 | — | — | |
| Acetic Acid SCHEMBL28823872 | 0.78 | FFAR3 (0.58) | — | |
| Acrylic Acid SCHEMBL29575435 | 0.78 | LMNA (0.83) | — | |
| Acetic Acid SCHEMBL20764 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109923141-A | Personal care composition comprising polyurethane-polyorganosiloxane copolymer | 美国陶氏有机硅公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109789317-A | Copolymer compositions for personal nursing | 美国陶氏有机硅公司 | 2019-05-21 | — | — | CN | disclosed |