⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1320240 | 0.82 | — | — | |
| SCHEMBL12122299 | 0.58 | ACHE (0.30) | — | |
| SCHEMBL1320209 | 0.57 | — | — | |
| SCHEMBL1319279 | 0.56 | — | — | |
| SCHEMBL18033929 | 0.54 | — | — | |
| SCHEMBL18908545 | 0.52 | — | — | |
| SCHEMBL20125003 | 0.52 | ACHE (0.34) | — | |
| SCHEMBL689864 | 0.49 | — | — | |
| SCHEMBL15043558 | 0.49 | ALDH1A1 (0.36) | — | |
| SCHEMBL22228296 | 0.48 | — | — |
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-2368896-B1 | Mono-indenyl transition metal compounds and polymerization therewith | EXXONMOBIL CHEM PATENTS INC (US) | 2016-08-24 | — | — | EP | disclosed |
| US-8058461-B2 | Mono-indenyl transition metal compounds and polymerization therewith | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2011-11-15 | — | — | US | disclosed |
| EP-2368896-A1 | Mono-indenyl transition metal compounds and polymerization therewith | ExxonMobil Chemical Patents Inc. (US) | 2011-09-28 | — | — | EP | disclosed |
| US-20110213109-A1 | Mono-Indenyl Transition Metal Compounds and Polymerization Therewith | EXXONMOBIL CHEMICAL PATENTS INC. | 2011-09-01 | — | — | US | disclosed |