⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6854471 | 1.00 | — | — | |
| SCHEMBL27337829 | 0.77 | — | — | |
| SCHEMBL14481306 | 0.76 | — | — | |
| SCHEMBL7648513 | 0.76 | — | — | |
| SCHEMBL598347 | 0.75 | — | — | |
| SCHEMBL789105 | 0.75 | — | — | |
| SCHEMBL790489 | 0.75 | — | — | |
| SCHEMBL598348 | 0.75 | — | — | |
| SCHEMBL790490 | 0.75 | — | — | |
| SCHEMBL28729455 | 0.75 | — | — |
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-6784255-B1 | RUBBER COMPOSITION FOR EXTRUSION TO GIVE A RIBBON- LIKE COMPOUND PREPARED PRIOR TO EXTRUSION HAVING NO CRACK NOR TEAR, STABLE CROSS SECTIONAL SHAPE OF EXTRUDATE, AND FOAMED PRODUCTS WITH LITTLE VARIATION IN FOAMING | MITSUI CHEMICALS INC. (JP) | 2004-08-31 | — | — | US | disclosed |
| EP-1209194-A1 | RUBBER COMPOSITION FOR EXTRUSION MOLDING AND FOR MOLDING WITH MOLD AND USE THEREOF | Mitsui Chemicals, Inc. (JP) | 2002-05-29 | — | — | EP | disclosed |