⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11195958 | 0.78 | — | — | |
| SCHEMBL19165680 | 0.78 | — | — | |
| SCHEMBL10167937 | 0.76 | — | — | |
| SCHEMBL12609375 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL28151937 | 0.74 | — | — | |
| SCHEMBL2552749 | 0.74 | — | — | |
| SCHEMBL19165317 | 0.74 | — | — | |
| SCHEMBL7305893 | 0.74 | — | — | |
| SCHEMBL9767473 | 0.72 | TSHR (0.61) | — | |
| SCHEMBL9767481 | 0.72 | TSHR (0.61) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1373346-A1 | ANIONIC POLYURETHANES WITH ELASTIC PROPERTY | L'OREAL (FR) | 2004-01-02 | — | — | EP | claimed |
| WO-2002070577-A1 | ANIONIC POLYURETHANES WITH ELASTIC PROPERTY | L'OREAL (FR) | 2002-09-12 | — | — | WO | claimed |