⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8035865 | 0.88 | — | — | |
| SCHEMBL8327276 | 0.70 | — | — | |
| SCHEMBL9522789 | 0.68 | — | — | |
| SCHEMBL10569471 | 0.63 | — | — | |
| SCHEMBL9619219 | 0.63 | EPHX1 (0.36) | — | |
| SCHEMBL8327277 | 0.62 | EPHX1 (0.34) | — | |
| SCHEMBL1108447 | 0.61 | EPHX1 (0.42) | — | |
| SCHEMBL11662886 | 0.60 | KCNA4 (0.32) | — | |
| Methane SCHEMBL9788186 | 0.59 | EPHX1 (0.41) | — | |
| SCHEMBL11912902 | 0.58 | EPHX1 (0.38) | — |
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-6096692-A | CYLIC KETALS AND ACDTALS HAVING HEAT AND OXIDATION RESISTANCE, ARE FREE FROM CARBOXYLIC ACIDS FORMING DUE TO HYDROLYSIS, LOW IN HYGROSCOPICITY, INEXPENSIVE, GOOD INSULATION AND COMPATIBLE WITH HYDROFLUOROCARBONS; WORKING FLUID REFRIGERANTS | KAO CORPORATION (JP) | 2000-08-01 | — | — | US | disclosed |
| EP-0779289-A1 | SYNTHETIC LUBRICATING OIL | Kao Corporation (JP) | 1997-06-18 | — | — | EP | disclosed |