⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1758886 | 1.00 | — | — | |
| SCHEMBL2827634 | 1.00 | — | — | |
| SCHEMBL8873160 | 0.87 | ESR1 (0.31) | — | |
| SCHEMBL466111 | 0.78 | — | — | |
| SCHEMBL1314044 | 0.75 | — | — | |
| SCHEMBL2500697 | 0.72 | CHRNB2 (0.36) | — | |
| SCHEMBL10582554 | 0.69 | — | — | |
| SCHEMBL649338 | 0.68 | — | — | |
| SCHEMBL3023028 | 0.62 | — | — | |
| SCHEMBL429474 | 0.62 | — | — |
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-20070191563-A1 | Method of manufacturing thermoplastic resin, crosslinked resin, and crosslinked resin composite material | ZEON CORPORATION (JP) | 2007-08-16 | — | — | US | disclosed |