⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5981777 | 0.75 | NPY1R (0.31) | — | |
| SCHEMBL11878908 | 0.50 | TSHR (0.71) | — | |
| SCHEMBL21183996 | 0.50 | ACHE (0.40) | — | |
| P-Xylene SCHEMBL28331001 | 0.49 | ACHE (0.67) | — | |
| P-Xylene SCHEMBL28336749 | 0.49 | ACHE (0.80) | — | |
| P-Xylene SCHEMBL11553864 | 0.49 | ACHE (0.80) | — | |
| SCHEMBL166690 | 0.49 | TSHR (1.00) | — | |
| SCHEMBL5495871 | 0.49 | TSHR (1.00) | — | |
| SCHEMBL855240 | 0.49 | MAPT (0.58) | — | |
| P-Xylene SCHEMBL460348 | 0.48 | ACHE (1.00) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8513368-B2 | Copolymer of olefin and conjugated diene, and process for producing the same | MITSUI CHEMICALS, INC. (JP) | 2013-08-20 | — | — | US | disclosed |
| EP-1988104-B1 | Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization | MITSUI CHEMICALS INC (JP) | 2010-03-03 | — | — | EP | disclosed |
| EP-1614699-B9 | PROPYLENE COPOLYMER, POLYPROPYLENE COMPOSITION, USE THEREOF, TRANSITION METAL COMPOUNDS, AND CATALYSTS FOR OLEFIN POLYMERIZATION | MITSUI CHEMICALS INC (JP) | 2009-12-16 | — | — | EP | disclosed |
| EP-1985637-A1 | Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization | Mitsui Chemicals, Inc. (JP) | 2008-10-29 | — | — | EP | disclosed |
| EP-1985638-A1 | Propylene copolymer, polypropylene composition, use thereof, transition metal compounds, and catalysts for olefin polymerization | Mitsui Chemicals, Inc. (JP) | 2008-10-29 | — | — | EP | disclosed |
| EP-1614699-B1 | PROPYLENE COPOLYMER, POLYPROPYLENE COMPOSITION, USE THEREOF, TRANSITION METAL COMPOUNDS, AND CATALYSTS FOR OLEFIN POLYMERIZATION | MITSUI CHEMICALS INC (JP) | 2008-10-15 | — | — | EP | disclosed |
| EP-1614699-A1 | PROPYLENE COPOLYMER, POLYPROPYLENE COMPOSITION, USE THEREOF, TRANSITION METAL COMPOUNDS, AND CATALYSTS FOR OLEFIN POLYMERIZATION | Mitsui Chemicals, Inc. (JP) | 2006-01-11 | — | — | EP | disclosed |