⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6690566 | 0.79 | PTPN1 (0.33) | — | |
| SCHEMBL96057 | 0.76 | CYP1A2 (0.31) | — | |
| SCHEMBL28237196 | 0.75 | — | — | |
| SCHEMBL6703542 | 0.74 | HMGB1 (0.34) | — | |
| SCHEMBL94558 | 0.72 | CYP1A2 (0.39) | — | |
| SCHEMBL31247992 | 0.71 | HSD17B10 (0.38) | — | |
| SCHEMBL22802151 | 0.71 | TSHR (0.43) | — | |
| SCHEMBL4380669 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL28237108 | 0.70 | SIRT1 (0.33) | — | |
| SCHEMBL27860101 | 0.69 | KDM4E (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040209967-A1 | FLAME RETARDED STYRENIC POLYMER FOAMS | ALBEMARLE CORPORATION | 2004-10-21 | — | — | US | claimed |
| WO-2004094517-A1 | FLAME RETARDED STYRENIC POLYMER FOAMS | ALBEMARLE CORPORATION (US) | 2004-11-04 | — | — | WO | disclosed |
| US-20040209967-A1 | FLAME RETARDED STYRENIC POLYMER FOAMS | ALBEMARLE CORPORATION | 2004-10-21 | — | — | US | disclosed |