⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7755370 | 0.91 | TSHR (0.46) | — | |
| SCHEMBL7654 | 0.91 | — | — | |
| Hydroxyamine SCHEMBL6567269 | 0.87 | — | — | |
| SCHEMBL17472833 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL3287565 | 0.86 | — | — | |
| SCHEMBL17491167 | 0.86 | — | — | |
| SCHEMBL9144055 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL1899233 | 0.86 | — | — | |
| SCHEMBL17491166 | 0.86 | — | — | |
| Water SCHEMBL27888240 | 0.86 | — | — |
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-3390552-A1 | CATALYST HAVING A POLYSILOXANE STRUCTURAL UNIT FOR HARDENABLE COMPOSITIONS | Sika Technology AG (CH) | 2018-10-24 | — | — | EP | disclosed |
| EP-3294803-A1 | CATALYST CONTAINING GUANIDINE GROUPS | Sika Technology AG (CH) | 2018-03-21 | — | — | EP | disclosed |