⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2507946 | 0.92 | HTR1A (0.31) | — | |
| SCHEMBL2505250 | 0.90 | PAOX (0.33) | — | |
| SCHEMBL2508615 | 0.89 | — | — | |
| SCHEMBL2502676 | 0.85 | CA12 (0.32) | — | |
| SCHEMBL2508151 | 0.80 | HTR1A (0.32) | — | |
| SCHEMBL2505374 | 0.79 | KDM5A (0.33) | — | |
| SCHEMBL2504746 | 0.79 | CHRM2 (0.30) | — | |
| SCHEMBL2508429 | 0.79 | — | — | |
| SCHEMBL2501777 | 0.78 | — | — | |
| SCHEMBL2506152 | 0.77 | KDM5A (0.32) | — |
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 |