SCHEMBL5086735

SCHEMBL5086735

CCCCC1=CCC([Zr]C2=C(CCCC)C(CCCC)=CC2)=C1CCCC

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
Hydrochloric Acid SCHEMBL7807818 0.98
SCHEMBL2905552 0.94
SCHEMBL7640007 0.90
SCHEMBL7640014 0.90
SCHEMBL27486433 0.83 ALOX5 (0.33)
Hydrochloric Acid SCHEMBL4974108 0.82
SCHEMBL1070456 0.80 ALOX5 (0.31)
SCHEMBL5604220 0.80 NPC1 (0.31)
Carbon Monoxide SCHEMBL11589678 0.79
SCHEMBL6284022 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021108049-A1 SYSTEMS AND METHODS FOR PRODUCING A SUPPORTED CATALYST EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-06-03 WO disclosed
EP-2872539-A1 INCREASED POLYMER MELT FLOW RATIO VIA FEED OF A SUPPORTED CATALYST SATURATED WITH A SELECTED LIQUID AGENT Univation Technologies, LLC (US) 2015-05-20 EP disclosed
WO-2014011357-A1 INCREASED POLYMER MELT FLOW RATIO VIA FEED OF A SUPPORTED CATALYST SATURATED WITH A SELECTED LIQUID AGENT UNIVATION TECHNOLOGIES, LLC (US) 2014-01-16 WO disclosed
EP-1899385-A1 POLYMERIZATION PROCESS USING SPRAY-DRIED CATALYST Univation Technologies, LLC (US) 2008-03-19 EP disclosed
WO-2007001665-A1 POLYMERIZATION PROCESS USING SPRAY-DRIED CATALYST UNIVATION TECHNOLOGIES, LLC (US) 2007-01-04 WO disclosed