⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2360921 | 0.80 | — | — | |
| SCHEMBL2360633 | 0.76 | — | — | |
| SCHEMBL4999955 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL10949411 | 0.72 | CYP1A2 (0.31) | — | |
| SCHEMBL819708 | 0.69 | — | — | |
| SCHEMBL1822156 | 0.69 | — | — | |
| SCHEMBL6535030 | 0.65 | — | — | |
| SCHEMBL2336574 | 0.65 | — | — | |
| SCHEMBL29201558 | 0.62 | — | — | |
| SCHEMBL8852579 | 0.62 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2231740-B1 | MOISTURE-CURABLE SILYLATED POLYUREA AND ADHESIVE, SEALANT AND COATING COMPOSITIONS CONTAINING SAME | MOMENTIVE PERFORMANCE MAT INC (US) | 2011-08-24 | — | — | EP | claimed |