⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL817848 | 0.93 | — | — | |
| SCHEMBL9112249 | 0.80 | — | — | |
| SCHEMBL11664765 | 0.77 | — | — | |
| SCHEMBL8848380 | 0.76 | — | — | |
| SCHEMBL4557041 | 0.76 | — | — | |
| SCHEMBL1507300 | 0.75 | — | — | |
| SCHEMBL13546944 | 0.75 | — | — | |
| SCHEMBL3605768 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL3591493 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL10514518 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110275756-A1 | CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-11-10 | — | — | US | disclosed |