SCHEMBL1921674

SCHEMBL1921674

[Li]C1=C(CCC)C=CC1

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
SCHEMBL253610 0.87
SCHEMBL7203737 0.85 ACHE (0.32)
SCHEMBL5090216 0.84 ACHE (0.34)
SCHEMBL28456647 0.84 ACHE (0.34)
SCHEMBL1921327 0.81
SCHEMBL7941320 0.77
SCHEMBL6305825 0.76
SCHEMBL26597790 0.76
SCHEMBL6053702 0.74
SCHEMBL28773321 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003500461-A 2003-01-07 JP claimed
EP-1100760-A4 SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES BOULDER SCIENT CO (US) 2002-08-07 EP claimed
EP-1100760-A1 SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES BOULDER SCIENTIFIC COMPANY (US) 2001-05-23 EP claimed
US-6175027-B1 CONVERTING CYCLOPENTADIENE TO A GRIGNARD REAGENT, THEN REACTING WITH AN ALKYL HALIDE TO PRODUCE MIXTURE OF ALKYL CYCLOPENTADIENE AND MAGNESIUM SALTS; QUENCHING THE MIXTURE WITH AQUEOUS ACETIC ACID TO PRODUCE ALKYL CYCLOPENTADIENE BOULDER SCIENTIFIC COMPANY 2001-01-16 US claimed
WO-2000073248-A1 SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES BOULDER SCIENTIFIC COMPANY (US) 2000-12-07 WO claimed
CN-115956093-A Catalyst comprising hybrid transition metal compound, olefin polymer prepared using the same, and method for preparing the same 韩华思路信株式会社 2023-04-11 CN disclosed
CN-111465626-B Polyethylene compositions and films made therefrom 埃克森美孚化学专利公司 2022-10-18 CN disclosed
CN-111511781-A Catalyst system and polymerization process using the same 埃克森美孚化学专利公司 2020-08-07 CN disclosed
CN-111465626-A Polyethylene compositions and films made therefrom 埃克森美孚化学专利公司 2020-07-28 CN disclosed
US-10626134-B2 Method for synthesis of monocyclopentadienyl complexes of zirconium and hafnium UNIVATION TECHNOLOGIES, LLC (US) 2020-04-21 US disclosed
CN-110573540-A Process for preparing catalyst system and polymerizing olefins 埃克森美孚化学专利公司 2019-12-13 CN disclosed
US-20190194238-A1 METHOD FOR SYNTHESIS OF MONOCYCLOPENTADIENYL COMPLEXES OF ZIRCONIUM AND HAFNIUM UNIVATION TECHNOLOGIES, LLC (US) 2019-06-27 US disclosed
EP-1498178-A2 Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex and process for producing olefin polymers Sumitomo Chemical Company, Limited (JP) 2005-01-19 EP disclosed
CN-1185236-C Transition metal compound, its producing process olefine polymerization catalyst containing the same transition metal compound and process for producing olefine polymer SUMITOMO CHEMICAL CO (JP) 2005-01-19 CN disclosed
EP-0842939-B1 OLEFIN POLYMERIZATION CATALYST CONTAINING A TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6329478-B1 SOLUBILITY IN SATURATED HYDROCARBON SOLVENTS SUMITMO CHEMICAL COMPANY, LIMITED 2001-12-11 US disclosed
CN-1310183-A Transition metal compound, its producing process olefine polymerization catalyst containing the same transition metal compound and process for producing olefine polymer SUMITOMO CHEMICAL CO (JP) 2001-08-29 CN disclosed
CN-1068884-C Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex, and process for producing olefin polymer SUMITOMO CHEM IND (JP) 2001-07-25 CN disclosed
CN-1193323-A Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex, and process for producing olefin polymer SUMITOMO CHEM IND (JP) 1998-09-16 CN disclosed
EP-0842939-A1 TRANSITION METAL COMPLEX, PROCESS FOR THE PREPARATION THEREOF, POLYMERIZATION CATALYST FOR OLEFINS CONTAINING THE COMPLEX, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-20 EP disclosed