⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28267678 | 0.78 | HDAC3 (0.32) | — | |
| SCHEMBL393157 | 0.75 | ESR1 (0.33) | — | |
| SCHEMBL28740043 | 0.75 | — | — | |
| SCHEMBL315055 | 0.73 | — | — | |
| SCHEMBL7456171 | 0.72 | MGAM (0.38) | — | |
| SCHEMBL27795313 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL314304 | 0.70 | SLC7A5 (0.31) | — | |
| SCHEMBL28170502 | 0.69 | KDM4E (0.36) | — | |
| SCHEMBL8656142 | 0.69 | — | — | |
| SCHEMBL2535453 | 0.69 | — | — |
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-6300406-B1 | USED IN ENDLESS SEAMLESS BELT HAVING THE ABOVE COMPOSITION IS SUITED AS AN INTERMEDIATE IMAGE TRANSFER ELEMENT FOR AN ELECTROPHOTOGRAPHIC IMAGE FORMING APPARATUS | OKURA INDUSTRIAL CO., LTD. (JP) | 2001-10-09 | — | — | US | disclosed |