SCHEMBL2171669

SCHEMBL2171669

C[NH+](C)c1ccccc1.Fc1ccc2c([B-](c3c(F)c(F)c(F)c4c(F)c(F)ccc34)(c3c(F)c(F)c(F)c4c(F)c(F)ccc34)c3c(F)c(F)c(F)c4c(F)c(F)ccc34)c(F)c(F)c(F)c2c1F

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
Trimethylammonium SCHEMBL21273394 0.86
SCHEMBL29907880 0.84
SCHEMBL29497620 0.84
SCHEMBL394834 0.84
SCHEMBL5716530 0.82
SCHEMBL29370626 0.81
SCHEMBL215386 0.81
SCHEMBL29394013 0.81
Methylamine SCHEMBL29396693 0.81
SCHEMBL116944 0.81

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9745390-B2 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-08-29 US claimed
EP-3022238-A1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM ExxonMobil Chemical Patents Inc. (US) 2016-05-25 EP claimed
US-20160130374-A1 Metallocenes and Catalyst Compositions Derived Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2016-05-12 US claimed
WO-2015009470-A1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-01-22 WO claimed
US-20150025205-A1 Metallocenes and Catalyst Compositions Derived Tehrefrom EXXONMOBIL CHEMICAL PATENTS INC. 2015-01-22 US claimed
US-11643485-B2 Ethylene-based polymer, polyethylene-based resin composition and use thereof, catalyst component for olefin polymerization, olefin polymerization catalyst containing the component, and method for producing ethylene-based polymer by using the catalyst JAPAN POLYETHYLENE CORPORATION (JP) 2023-05-09 US disclosed
US-10633471-B2 Ethylene-based polymer, polyethylene-based resin composition and use thereof, catalyst component for olefin polymerization, olefin polymerization catalyst containing the component, and method for producing ethylene-based polymer by using the catalyst JAPAN POLYETHYLENE CORPORATION (JP) 2020-04-28 US disclosed
US-20200031965-A1 ETHYLENE-BASED POLYMER, POLYETHYLENE-BASED RESIN COMPOSITION AND USE THEREOF, CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, OLEFIN POLYMERIZATION CATALYST CONTAINING THE COMPONENT, AND METHOD FOR PRODUCING ETHYLENE-BASED POLYMER BY USING THE CATALYST JAPAN POLYETHYLENE CORPORATION (JP) 2020-01-30 US disclosed
EP-3022237-B1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-10-03 EP disclosed
US-20180237565-A1 ETHYLENE-BASED POLYMER, POLYETHYLENE-BASED RESIN COMPOSITION AND USE THEREOF, CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, OLEFIN POLYMERIZATION CATALYST CONTAINING THE COMPONENT, AND METHOD FOR PRODUCING ETHYLENE-BASED POLYMER BY USING THE CATALYST JAPAN POLYETHYLENE CORPORATION (JP) 2018-08-23 US disclosed
US-9975972-B2 Ethylene-based polymer, polyethylene-based resin composition and use thereof, catalyst component for olefin polymerization, olefin polymerization catalyst containing the component, and method for producing ethylene-based polymer by using the catalyst JAPAN POLYETHYLENE CORPORATION (JP) 2018-05-22 US disclosed
US-9644047-B2 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-05-09 US disclosed
EP-2528957-B1 COPOLYMERS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING THEM EXXONMOBIL CHEM PATENTS INC (US) 2014-10-22 EP disclosed
US-20140194277-A1 ETHYLENE-BASED POLYMER, POLYETHYLENE-BASED RESIN COMPOSITION AND USE THEREOF, CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, OLEFIN POLYMERIZATION CATALYST CONTAINING THE COMPONENT, AND METHOD FOR PRODUCING ETHYLENE-BASED POLYMER BY USING THE CATALYST JAPAN POLYETHYLENE CORPORATION (JP) 2014-07-10 US disclosed
US-8378048-B2 Copolymers, compositions thereof, and methods for making them EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-02-19 US disclosed
EP-2528957-A1 COPOLYMERS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING THEM ExxonMobil Chemical Patents Inc. (US) 2012-12-05 EP disclosed
WO-2011094057-A1 COPOLYMERS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING THEM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-08-04 WO disclosed
US-20110184134-A1 Copolymers, Compositions Thereof, and Methods for Making Them EXXONMOBIL CHEMICAL PATENTS INC. 2011-07-28 US disclosed
US-7166684-B2 Transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2007-01-23 US disclosed
US-20060167196-A1 Novel transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2006-07-27 US disclosed