⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8145838 | 0.97 | EPHX1 (0.33) | — | |
| SCHEMBL9386898 | 0.76 | THRB (0.36) | — | |
| SCHEMBL844660 | 0.75 | — | — | |
| SCHEMBL3146924 | 0.75 | — | — | |
| SCHEMBL16132510 | 0.75 | EPHX1 (0.32) | — | |
| SCHEMBL16933739 | 0.75 | — | — | |
| SCHEMBL879449 | 0.73 | LMNA (0.38) | — | |
| SCHEMBL15151738 | 0.73 | EPHX1 (0.35) | — | |
| SCHEMBL8502985 | 0.73 | LMNA (0.38) | — | |
| SCHEMBL6548551 | 0.73 | CES2 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000003066-A1 | METHOD OF ELECTROCHEMICALLY PRODUCING EPOXIDES | PPG INDUSTRIES OHIO, INC. (US) | 2000-01-20 | — | — | WO | disclosed |
| US-5997716-A | Method of electrochemically producing epoxides | PPG INDUSTRIES OHIO, INC. (US) | 1999-12-07 | — | — | US | disclosed |
| US-5997715-A | Method of electrochemically producing epoxides | PPG INDUSTRIES OHIO, INC. (US) | 1999-12-07 | — | — | US | disclosed |
| US-5980724-A | Method of electrochemically producing epoxides | PPG INDUSTRIES OHIO, INC. (US) | 1999-11-09 | — | — | US | disclosed |
| US-5972195-A | Method of electrolytically producing epoxides | PPG INDUSTRIES OHIO, INC. (US) | 1999-10-26 | — | — | US | disclosed |