⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22582300 | 1.00 | CXCR4 (0.67) | — | |
| SCHEMBL472205 | 0.96 | CXCR4 (0.75) | — | |
| SCHEMBL20523496 | 0.92 | — | — | |
| SCHEMBL30338212 | 0.92 | CXCR4 (0.69) | — | |
| SCHEMBL27902303 | 0.92 | CXCR4 (0.69) | — | |
| Piperazine SCHEMBL28322579 | 0.91 | CXCR4 (0.67) | — | |
| SCHEMBL5595 | 0.85 | — | — | |
| SCHEMBL11235838 | 0.85 | CXCR4 (0.89) | — | |
| SCHEMBL472132 | 0.85 | CXCR4 (0.89) | — | |
| SCHEMBL11232630 | 0.85 | CXCR4 (0.89) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1337536-B1 | CATIONIC GROUP-3 CATALYST SYSTEM | EXXONMOBIL CHEM PATENTS INC (US) | 2012-09-12 | — | — | EP | disclosed |
| EP-1355736-B1 | CATIONIC CATALYST SYSTEM | EXXONMOBIL CHEM PATENTS INC (US) | 2011-07-20 | — | — | EP | disclosed |
| US-7390861-B2 | Cationic group-3 catalyst system | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2008-06-24 | — | — | US | disclosed |
| US-7196148-B2 | For coordination polymerization of olefins | EXXON MOBIL CHEMICAL PATENTS INC. (US) | 2007-03-27 | — | — | US | disclosed |
| US-20040033891-A1 | Cationic group-3 catalyst system | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-02-19 | — | — | US | disclosed |
| US-20040024234-A1 | Cationic catalyst system | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-02-05 | — | — | US | disclosed |
| EP-1355736-A2 | CATIONIC CATALYST SYSTEM | ExxonMobil Chemical Patents Inc. (US) | 2003-10-29 | — | — | EP | disclosed |
| WO-2002059157-A2 | CATIONIC CATALYST SYSTEM | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-08-01 | — | — | WO | disclosed |