⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL78625 | 0.77 | — | — | |
| SCHEMBL8906476 | 0.67 | — | — | |
| SCHEMBL1824769 | 0.65 | — | — | |
| SCHEMBL78997 | 0.59 | — | — | |
| SCHEMBL6053242 | 0.58 | — | — | |
| SCHEMBL135576 | 0.55 | — | — | |
| SCHEMBL2238246 | 0.55 | — | — | |
| SCHEMBL28905334 | 0.54 | ALDH1A1 (0.31) | — | |
| SCHEMBL4012498 | 0.54 | — | — | |
| SCHEMBL135415 | 0.53 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3394121-A1 | PROCESS FOR THE PREPARATION OF (CO) POLYMERS OF CONJUGATED DIENES IN THE PRESENCE OF A CATALYTIC SYSTEM COMPRISING A VANADIUM BIS-IMINE COMPLEX | Versalis S.p.A. (IT) | 2018-10-31 | — | — | EP | disclosed |
| WO-2017109767-A1 | PROCESS FOR THE PREPARATION OF (CO) POLYMERS OF CONJUGATED DIENES IN THE PRESENCE OF A CATALYTIC SYSTEM COMPRISING A VANADIUM BIS-IMINE COMPLEX | VERSALIS S.P.A. (IT) | 2017-06-29 | — | — | WO | disclosed |
| US-6372684-B1 | COORDINATION CATALYSTS COMPRISING ZIRCONIUM, TITANIUM, OR HAFNIUM METAL COMPLEX WITH BIS-AMIDO COMPOUND; BORON COMPOUND COCATALYST; AND ORGANOALUMINUM COMPOUNDS; ADDITION POLYMERIZATION; CATALYST SELECTIVITY | SHELL OIL COMPANY | 2002-04-16 | — | — | US | disclosed |
| US-20020035219-A1 | Catalyst system for alpha-olefin oligomerization | HORTON ANDREW D (NL) | 2002-03-21 | — | — | US | disclosed |
| EP-1073521-A1 | CATALYST SYSTEM FOR ALPHA-OLEFIN OLIGOMERIZATION | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999052631-A1 | CATALYST SYSTEM FOR α-OLEFIN OLIGOMERIZATION | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1999-10-21 | — | — | WO | disclosed |