⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL8081994 | 0.95 | — | — | |
| SCHEMBL600277 | 0.78 | — | — | |
| SCHEMBL7871365 | 0.78 | — | — | |
| SCHEMBL21448655 | 0.75 | — | — | |
| Water SCHEMBL16566506 | 0.74 | — | — | |
| SCHEMBL3945315 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL8644309 | 0.74 | — | — | |
| SCHEMBL19070789 | 0.73 | — | — | |
| SCHEMBL1100490 | 0.72 | — | — | |
| SCHEMBL7875154 | 0.72 | — | — |
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-9304448-B2 | Intermediate transfer members | XEROX CORPORATION (US) | 2016-04-05 | — | — | US | disclosed |
| US-20150076413-A1 | INTERMEDIATE TRANSFER MEMBERS | XEROX CORPORATION (US) | 2015-03-19 | — | — | US | disclosed |