SCHEMBL2522927

SCHEMBL2522927

CCCCC1=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc2C1[Zr](Cl)(Cl)C1C(CCCC)=Cc2c(-c3ccc(C(C)(C)C)cc3)cccc21

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL2526442 0.96
SCHEMBL2526491 0.93 BRD4 (0.30)
SCHEMBL2524024 0.88 NR1H4 (0.32)
SCHEMBL6908943 0.84
SCHEMBL27567397 0.83 GCGR (0.31)
Hydrochloric Acid SCHEMBL27464017 0.81 BRD4 (0.30)
SCHEMBL817419 0.81
SCHEMBL15313046 0.81
SCHEMBL5364240 0.81
SCHEMBL7039419 0.81 NPC1 (0.32)

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2033975-B1 Catalyst composition BASELL POLYOLEFINE GMBH (DE) 2014-05-14 EP disclosed
US-8039569-B2 Polyethylene molding compositions for injection molding applications BASELL POLYOLEFINE GMBH (DE) 2011-10-18 US disclosed
EP-1874830-B1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST BASELL POLYOLEFINE GMBH (DE) 2010-10-20 EP disclosed
US-20090311453-A1 Molding compostion comprsing polyethlene for preparing films and process for preparing the molding composition in the presence of a mixed catalyst BASELL POLYOLEFINE GMBH (DE) 2009-12-17 US disclosed
US-20090306324-A1 Polyethylene molding compositions for injection molding applications BASELL POLYOLEFINE GMBH (DE) 2009-12-10 US disclosed
EP-2033975-A1 Catalyst composition Basell Polyolefine GmbH (DE) 2009-03-11 EP disclosed
EP-1874831-B1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS BASELL POLYOLEFINE GMBH (DE) 2008-12-03 EP disclosed
EP-1874831-A1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS Basell Polyolefine GmbH (DE) 2008-01-09 EP disclosed
EP-1874830-A1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST Basell Polyolefine GmbH (DE) 2008-01-09 EP disclosed
WO-2006114209-A1 MOLDING COMPOSITION COMPRISING POLYETHYLENE FOR PREPARING FILMS AND PROCESS FOR PREPARING THE MOLDING COMPOSITION IN THE PRESENCE OF A MIXED CATALYST BASELL POLYOLEFINE GMBH (DE) 2006-11-02 WO disclosed
WO-2006114210-A1 POLYETHYLENE MOLDING COMPOSITIONS FOR INJECTION MOLDING APPLICATIONS BASELL POLYOLEFINE GMBH (DE) 2006-11-02 WO disclosed