⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2504852 | 0.77 | — | — | |
| SCHEMBL15981421 | 0.72 | — | — | |
| SCHEMBL4529270 | 0.69 | — | — | |
| SCHEMBL24729166 | 0.67 | — | — | |
| SCHEMBL25466802 | 0.65 | EPHX1 (0.41) | — | |
| SCHEMBL23841894 | 0.65 | EPHX1 (0.41) | — | |
| SCHEMBL7052805 | 0.64 | RXFP1 (0.38) | — | |
| SCHEMBL18756771 | 0.64 | — | — | |
| SCHEMBL22338049 | 0.64 | ADRB2 (0.33) | — | |
| SCHEMBL4525900 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8304488-B2 | Conjugated diene polymer, conjugated diene polymer composition, and method for producing conjugated diene polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-11-06 | — | — | US | disclosed |
| US-20110245408-A1 | CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-10-06 | — | — | US | disclosed |