⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2856330 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL1985790 | 0.77 | — | — | |
| SCHEMBL27316095 | 0.66 | ELANE (0.35) | — | |
| SCHEMBL2856800 | 0.65 | — | — | |
| SCHEMBL28286476 | 0.65 | HSD11B1 (0.37) | — | |
| SCHEMBL27419035 | 0.64 | HSD11B1 (0.36) | — | |
| Hydrochloric Acid SCHEMBL1776903 | 0.63 | — | — | |
| SCHEMBL27518178 | 0.62 | PSMB5 (0.35) | — | |
| Hydrochloric Acid SCHEMBL1776821 | 0.62 | — | — | |
| SCHEMBL2850384 | 0.61 | — | — |
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 4 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 |