⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5158035 | 0.66 | — | — | |
| SCHEMBL524228 | 0.61 | — | — | |
| SCHEMBL29394441 | 0.61 | ADORA3 (0.33) | — | |
| Uric Acid SCHEMBL15777793 | 0.59 | — | — | |
| SCHEMBL9514014 | 0.59 | — | — | |
| SCHEMBL8382084 | 0.56 | — | — | |
| SCHEMBL34276 | 0.56 | — | — | |
| Hydrochloric Acid SCHEMBL19549245 | 0.54 | — | — | |
| SCHEMBL1389268 | 0.54 | — | — | |
| Hydrazine SCHEMBL3475792 | 0.53 | — | — |
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-3320051-A1 | METHOD FOR PRODUCING ORGANOPOLYSILOXANES WITH (METH)ACRYLATE FUNCTIONS | Bluestar Silicones France SAS (FR) | 2018-05-16 | — | — | EP | disclosed |