⚠ 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 | |
|---|---|---|---|---|
| Trichloromonofluoromethane SCHEMBL8534292 | 0.90 | — | — | |
| Dichlorodifluoromethane SCHEMBL29031908 | 0.90 | — | — | |
| Trichloromonofluoromethane SCHEMBL9245307 | 0.86 | ALDH1A1 (0.38) | — | |
| Dichlorotetrafluoroethane SCHEMBL9754437 | 0.86 | ALDH1A1 (0.38) | — | |
| SCHEMBL11379074 | 0.82 | ALDH1A1 (0.35) | — | |
| SCHEMBL5011959 | 0.82 | — | — | |
| Chloropentafluoroethane SCHEMBL11077860 | 0.82 | ALDH1A1 (0.35) | — | |
| Dichlorodifluoromethane SCHEMBL7261256 | 0.80 | — | — | |
| Trichloromonofluoromethane SCHEMBL11647929 | 0.80 | — | — | |
| Chloromethane SCHEMBL20822317 | 0.78 | — | — |
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-5711934-A | Process for the continuous milling of aerosol pharmaceutical formulations in aerosol propellants | ABBOTT LABORATORIES (US) | 1998-01-27 | — | — | US | claimed |
| WO-2022238745-A1 | TOPICAL PHARMACEUTICAL COMPOSITION OF HIF PROLYL HYDROXYLASE INHIBITORS | ZYDUS LIFESCIENCES LIMITED (IN) | 2022-11-17 | — | — | WO | disclosed |