SCHEMBL5653553

SCHEMBL5653553

CCCCCCCCCCCCCCCCCC[NH+](CCCCCCCCCCCCCCCCCC)c1c(C)cc(C)cc1C.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

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
SCHEMBL5656636 0.85 PTGS1 (0.30)
SCHEMBL3982956 0.83 DNM1 (0.34)
SCHEMBL5088208 0.83 DNM1 (0.34)
SCHEMBL5654572 0.83 DNM1 (0.34)
SCHEMBL3988431 0.81
SCHEMBL31503934 0.78 HTT (0.33)
SCHEMBL7757776 0.78 HTT (0.33)
SCHEMBL29396593 0.76 P2RX7 (0.30)
SCHEMBL29396689 0.76 P2RX7 (0.30)
SCHEMBL29396403 0.76 P2RX7 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331753-A1 Ligand Compound, Organochromium Compound and Catalyst System Comprising the Same LG CHEM, LTD. (KR) 2023-10-19 US disclosed
CN-111715299-B Boron salt complex catalyst, preparation method and application thereof in ethylene oligomerization 万华化学集团股份有限公司 2023-03-24 CN disclosed
US-9035119-B2 Oligomerisation of olefinic compounds in the presence of an activated oligomerisation catalyst SASOL TECHNOLOGY (PTY) LIMITED (ZA) 2015-05-19 US disclosed
US-7098356-B2 Substituted indenyl metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES INC. (US) 2006-08-29 US disclosed
US-6943133-B2 Diene functionalized catalyst supports and supported catalyst compositions UNIVATION TECHNOLOGIES, LLC (US) 2005-09-13 US disclosed
EP-1373281-B1 METAL COMPLEXES CONTAINING ACETYLENIC LIGANDS, POLYMERIZATION CATALYSTS AND ADDITION POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2005-08-17 EP disclosed
US-20050143536-A1 Substituted indenyl metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES LLC 2005-06-30 US disclosed
US-6872844-B2 Metal complexes containing acetylenic ligands, polymerization catalysts and addition polymerization process THE DOW CHEMICAL COMPANY (US) 2005-03-29 US disclosed
US-20050010039-A1 Polycyclic fused heteroring compounds metal complexes and polymerization process GRAF DAVID D (US) 2005-01-13 US disclosed
US-6806327-B2 POLYMERIZATION CATALYSTS SUCH AS (8-METHYLENE-1,8-DIHYDRODIBENZO(E,H)AZULEN-1-YL)-N-(1,1-DIMETHYLETHYL) DIMETHYLSILANAMIDE TITANIUM (II) 1,4-DIPHENYL-1,2-BUTADIENE DOW GLOBAL TECHNOLOGIES INC. 2004-10-19 US disclosed
US-20040082769-A1 Metal complexes contanining acetylenic ligands, polymerization catalysts and addition polymerization process THE DOW CHEMICAL COMPANY 2004-04-29 US disclosed
EP-1373281-A1 METAL COMPLEXES CONTAINING ACETYLENIC LIGANDS, POLYMERIZATION CATALYSTS AND ADDITION POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2004-01-02 EP disclosed
US-20020183464-A1 3-aryl-substituted cyclopentadienyl metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES LLC 2002-12-05 US disclosed
US-20020151662-A1 Substituted polycyclic, fused ring compounds, metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES LLC 2002-10-17 US disclosed
WO-2002074779-A1 METAL COMPLEXES CONTAINING ACETYLENIC LIGANDS, POLYMERIZATION CATALYSTS AND ADDITION POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2002-09-26 WO disclosed
US-6420507-B1 COORDINATION CATALYSTS FOR POLYMERS THE DOW CHEMICAL COMPANY 2002-07-16 US disclosed
US-20020082161-A1 Diene functionalized catalyst supports and supported catalyst compositions THE DOW CHEMICAL COMPANY 2002-06-27 US disclosed
US-6319979-B1 HAVING A DENSITY OF 0.850-0.895 G/CM.3 ; TACKIFYING RESIN; AND UP TO 40 WEIGHT PERCENT OF AT LEAST ONE WAX, VISCOSITY OF LESS THAN ABOUT 5000 CPS (50 GRAMS/(CM.SECOND)) AT 150 DEGREES C. THE DOW CHEMICAL COMPANY 2001-11-20 US disclosed