⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21749921 | 0.76 | — | — | |
| SCHEMBL934500 | 0.74 | — | — | |
| SCHEMBL7737998 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL28174 | 0.72 | — | — | |
| SCHEMBL11702185 | 0.72 | TSHR (0.48) | — | |
| SCHEMBL4851320 | 0.69 | — | — | |
| SCHEMBL7054433 | 0.67 | — | — | |
| SCHEMBL339088 | 0.67 | — | — | |
| SCHEMBL6553239 | 0.67 | MEN1 (0.43) | — | |
| SCHEMBL4851315 | 0.67 | — | — |
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-6410748-B1 | Alicycli c group-containing monomer | KABUSHIKI KAISHA TOSHIBA (JP) | 2002-06-25 | — | — | US | disclosed |
| US-6291129-B1 | LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS | KABUSHIKI KAISHA TOSHIBA (JP) | 2001-09-18 | — | — | US | disclosed |