SCHEMBL1077392

SCHEMBL1077392

CC(C#CC(OOC(C)(C)C)C(C)C)OOC(C)(C)C

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
SCHEMBL625956 0.86 TSHR (0.39)
SCHEMBL15707963 0.72
SCHEMBL30578388 0.71
SCHEMBL29562215 0.64 ALDH1A1 (0.36)
SCHEMBL11673746 0.61 TSHR (0.47)
SCHEMBL8610913 0.61 TSHR (0.47)
SCHEMBL217037 0.61
SCHEMBL29145916 0.61 TSHR (0.39)
SCHEMBL8668941 0.59
SCHEMBL28299653 0.59 TSHR (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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2798002-B1 BIMODAL HIGH-DENSITY POLYETHYLENE RESINS AND COMPOSITIONS WITH IMPROVED PROPERTIES AND METHODS OF MAKING AND USING THE SAME INEOS OLEFINS & POLYMERS USA (US) 2020-08-19 EP claimed
WO-2006023371-A1 FUNCTIONALIZED POLY(ARYLENE ETHER) COMPOSITION AND METHOD GENERAL ELECTRIC COMPANY (US) 2006-03-02 WO claimed
EP-2196482-B1 Silane-grafted alpha-olefin-vinyl acetate copolymer containing crosslinkable silyl groups, process for the preparation thereof and use for the preparation of insulation or sheath materials for cables or lines ARLANXEO DEUTSCHLAND GMBH (DE) 2018-02-28 EP disclosed
EP-3262084-A1 HIGH-PRESSURE POLYMERIZATION PROCESS OF ETHYLENICALLY UNSATURATED MONOMERS Basell Polyolefine GmbH (DE) 2018-01-03 EP disclosed
WO-2016135077-A1 HIGH-PRESSURE POLYMERIZATION PROCESS OF ETHYLENICALLY UNSATURATED MONOMERS BASELL POLYOLEFINE GMBH (DE) 2016-09-01 WO disclosed
US-9082899-B2 Electrically conductive polymeric compositions, contacts, assemblies, and methods HERAEUS PRECIOUS METALS NORTH AMERICA CONSHOHOCKEN LLC (US) 2015-07-14 US disclosed
US-20150107659-A1 ELECTRICALLY CONDUCTIVE POLYMERIC COMPOSITIONS, CONTACTS, ASSEMBLIES, AND METHODS HERAEUS PRECIOUS METALS NORTH AMERICA CONSHOHOCKEN LLC (US) 2015-04-23 US disclosed
US-8779061-B2 Curable elastomeric compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2014-07-15 US disclosed
US-20130109811-A1 CURABLE ELASTOMERIC COMPOSITIONS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-02 US disclosed
EP-2272882-B1 Crosslinkable composition for power and/or telecommunication cable based on a silane cocktail and manufacturing method of said cable NEXANS (FR) 2011-08-31 EP disclosed
US-7989548-B2 Thermoplastic vulcanisate blend E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-08-02 US disclosed
US-7941938-B2 Article of footwear with lightweight sole assembly NIKE, INC. (US) 2011-05-17 US disclosed
EP-2272882-A1 Crosslinkable composition for power and/or telecommunication cable based on a silane cocktail and manufacturing method of said cable Nexans (FR) 2011-01-12 EP disclosed
EP-2196482-A1 Silane-grafted alpha-olefin-vinyl acetate copolymer containing crosslinkable silyl groups, process for the preparation thereof and use for the preparation of insulation or sheath materials for cables or lines Lanxess Deutschland GmbH (DE) 2010-06-16 EP disclosed
EP-1784433-A1 SOLID STATE MODIFICATION OF MULTIMODAL POLYETHYLENE Equistar Chemicals, LP (US) 2007-05-16 EP disclosed
WO-2006036348-A1 SOLID STATE MODIFICATION OF MULTIMODAL POLYETHYLENE EQUISTAR CHEMICALS, LP (US) 2006-04-06 WO disclosed
EP-1592747-A1 POLY(PHENYLENE ETHER) RESIN COMPOSITION, PREPREG, AND LAMINATED SHEET Matsushita Electric Works, Ltd. (JP) 2005-11-09 EP disclosed
WO-2004096909-A1 THERMOPLASTIC RESIN COMPOSITION LG CHEM. LTD. (KR) 2004-11-11 WO disclosed
WO-2004067634-A1 POLY(PHENYLENE ETHER) RESIN COMPOSITION, PREPREG, AND LAMINATED SHEET MATSUSHITA ELECTRIC WORKS, LTD. (JP) 2004-08-12 WO disclosed
US-4292106-A HEATING AN ETHYLENE HOMO- OR COPOLYMER AND AN ACETYLENIC DIPEROXY CATALYST; BONDING TO COUPLING SILANOL-TREATED GLASS FIBERS CLARK-SCHWEBEL FIBER GLASS CORP. (US) 1981-09-29 US disclosed