⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL900300 | 0.73 | — | — | |
| SCHEMBL10316514 | 0.69 | CYP3A4 (0.37) | — | |
| SCHEMBL4175287 | 0.64 | — | — | |
| SCHEMBL5027981 | 0.64 | — | — | |
| SCHEMBL24786143 | 0.60 | — | — | |
| SCHEMBL4952693 | 0.59 | TDP1 (0.31) | — | |
| SCHEMBL7990081 | 0.59 | — | — | |
| SCHEMBL7972784 | 0.59 | — | — | |
| SCHEMBL7972779 | 0.59 | — | — | |
| SCHEMBL815359 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2043751-B1 | COMPOSITION AND METHOD FOR DEMULSIFYING | MOMENTIVE PERFORMANCE MAT INC (US) | 2019-03-13 | — | — | EP | disclosed |
| US-7745501-B2 | Method for demulsifying | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2010-06-29 | — | — | US | disclosed |
| US-20070299143-A1 | Method for demulsifying | MOMENTIVE PERFORMANCE MATERIALS INC. | 2007-12-27 | — | — | US | disclosed |