⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL134969 | 0.79 | — | — | |
| SCHEMBL29035534 | 0.71 | OPRM1 (0.30) | — | |
| SCHEMBL242068 | 0.70 | — | — | |
| SCHEMBL11647862 | 0.67 | — | — | |
| SCHEMBL645823 | 0.67 | — | — | |
| SCHEMBL7926950 | 0.67 | — | — | |
| Dimethyl Fumarate SCHEMBL14966538 | 0.66 | HCAR2 (0.37) | — | |
| Dimethyl Fumarate SCHEMBL14935840 | 0.65 | HCAR2 (0.36) | — | |
| SCHEMBL21679576 | 0.64 | — | — | |
| SCHEMBL28287945 | 0.64 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016083233-A1 | ALKENYLDIALKYLCARBINOXY-FUNCTIONAL POLYDIORGANOSILOXANES | WACKER CHEMIE AG (DE) | 2016-06-02 | — | — | WO | disclosed |
| EP-1363767-B1 | RELEASE AGENT COMPOSITION | LEXMARK INT INC (US) | 2008-07-23 | — | — | EP | disclosed |
| EP-1363767-A4 | RELEASE AGENT COMPOSITION | LEXMARK INT INC (US) | 2004-11-17 | — | — | EP | disclosed |
| CN-1484580-A | Release agent composition | ����˹���ʹ�˾ | 2004-03-24 | — | — | CN | disclosed |
| EP-1363767-A1 | RELEASE AGENT COMPOSITION | Lexmark International, Inc. (US) | 2003-11-26 | — | — | EP | disclosed |
| US-6458461-B1 | POLYSILOXANE RELEASE AGENT; FUSER ROLLS | LEXMARK INTERNATIONAL, INC | 2002-10-01 | — | — | US | disclosed |
| US-20020098365-A1 | Polysiloxane release agent; fuser rolls | LEXMARK INTERNATIONAL, INC. | 2002-07-25 | — | — | US | disclosed |
| WO-2002045950-A1 | RELEASE AGENT COMPOSITION | LEXMARK INTERNATIONAL, INC. (US) | 2002-06-13 | — | — | WO | disclosed |