⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7596996 | 0.82 | — | — | |
| SCHEMBL7596498 | 0.79 | — | — | |
| SCHEMBL7602010 | 0.73 | — | — | |
| SCHEMBL27774613 | 0.68 | HTR2A (0.34) | — | |
| SCHEMBL6266174 | 0.68 | HTR2A (0.34) | — | |
| SCHEMBL8370739 | 0.67 | TACR1 (0.32) | — | |
| SCHEMBL7597679 | 0.65 | — | — | |
| SCHEMBL12814519 | 0.64 | LMNA (0.37) | — | |
| SCHEMBL813995 | 0.64 | LMNA (0.33) | — | |
| SCHEMBL8861792 | 0.63 | GPR3 (0.31) | — |
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-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | disclosed |