⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7941031 | 0.78 | ESR1 (0.33) | — | |
| SCHEMBL10455779 | 0.71 | — | — | |
| SCHEMBL727375 | 0.71 | — | — | |
| SCHEMBL2861499 | 0.71 | — | — | |
| SCHEMBL727392 | 0.68 | CALM1 (0.32) | — | |
| SCHEMBL464991 | 0.68 | ALDH1A1 (0.40) | — | |
| SCHEMBL3686373 | 0.67 | — | — | |
| SCHEMBL103831 | 0.66 | NPC1 (0.38) | — | |
| SCHEMBL17296053 | 0.66 | NR1H2 (0.38) | — | |
| SCHEMBL3687729 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0808850-B2 | Method of treating polyolefin | MITSUI CHEMICALS INC (JP) | 2010-01-13 | — | — | EP | disclosed |
| EP-0808850-B1 | Method of treating polyolefin | MITSUI CHEMICALS INC (JP) | 2001-09-19 | — | — | EP | disclosed |
| US-5990272-A | HEATING POLYOLEFIN CONTACTED WITH A LIGAND DECOMPOSER TO REMOVE DECOMPOSED METALLOCENE LIGANDS FROM THE POLYOLEFIN | MITSUI CHEMICALS, INC. (JP) | 1999-11-23 | — | — | US | disclosed |
| EP-0808850-A1 | Method of treating polyolefin | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1997-11-26 | — | — | EP | disclosed |
| EP-0718323-A2 | Ethylene type quaternary copolymer rubber | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-06-26 | — | — | EP | disclosed |