⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9853 | 0.89 | — | — | |
| Isopropyl Alcohol SCHEMBL29282854 | 0.86 | ALDH1A1 (0.55) | — | |
| SCHEMBL26597347 | 0.84 | — | — | |
| Bromide SCHEMBL28366176 | 0.84 | — | — | |
| SCHEMBL28100275 | 0.84 | — | — | |
| SCHEMBL28048891 | 0.84 | — | — | |
| SCHEMBL28211645 | 0.84 | — | — | |
| SCHEMBL2508334 | 0.84 | — | — | |
| SCHEMBL27437486 | 0.84 | — | — | |
| SCHEMBL27810857 | 0.84 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114456068-A | Synthetic method of methyl trifluoroethyl carbonate | 石家庄圣泰化工有限公司 | 2022-05-10 | — | — | CN | disclosed |
| EP-2593123-A1 | ROMIDEPSIN SOLID FORMS AND USES THEREOF | Celgene Corporation (US) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012009336-A1 | ROMIDEPSIN SOLID FORMS AND USES THEREOF | GLOUCESTER PHARMACEUTICALS, INC. (US) | 2012-01-19 | — | — | WO | disclosed |
| CN-100343283-C | Cellulose acylate and solution thereof | FUJI PHOTO FILM CO LTD (JP) | 2007-10-17 | — | — | CN | disclosed |
| CN-1639197-A | Cellulose acylate and solution thereof | FUJI PHOTO FILM CO LTD (JP) | 2005-07-13 | — | — | CN | disclosed |