SCHEMBL1133086

SCHEMBL1133086

CC1=C([Fe]C2=C(C)C=CC2)CC=C1

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
SCHEMBL11697034 0.83
SCHEMBL5776341 0.83
SCHEMBL3894435 0.83
SCHEMBL1132627 0.80
SCHEMBL19767296 0.69
SCHEMBL409596 0.67
SCHEMBL8162371 0.67
SCHEMBL216231 0.67
SCHEMBL1133064 0.67
SCHEMBL712173 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080079-B1 OXIDATION OF 2-MERCAPTOETHANOL BASF SE (DE) 2018-07-25 EP claimed
US-20160318860-A1 OXIDATION OF 2-MERCAPTOETHANOL BASF SE (DE) 2016-11-03 US claimed
US-20070215982-A1 Gallium Nitride Baseplate, Epitaxial Substrate, and Method of Forming Gallium Nitride SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2007-09-20 US claimed
US-5403620-A Catalysis in organometallic CVD of thin metal films REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1995-04-04 US claimed
US-5130172-A Coating on a substrate a metal, exposure and vaporization and reaction with hydrogenation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1992-07-14 US claimed
US-4979447-A USING A FERROCENE COMPOUND VELINO VENTURES INC. (CA) 1990-12-25 US claimed
EP-0346100-A1 Combustion of carbon containing materials in a furnace VELINO VENTURES INC. (CA) 1989-12-13 EP claimed
US-4139349-A DICYCLOPENTADIENYL IRON, CYCLOPENTADIENYL MANGANESE TRICARBONYL E. I. DU PONT DE NEMOURS & CO. (US) 1979-02-13 US claimed
EP-2171021-B2 USE OF A CONDUCTIVITY IMPROVER IN A HYDROCARBON COMPOSITION INNOSPEC LTD (GB) 2024-09-04 EP disclosed
EP-2171021-B1 USE OF A CONDUCTIVITY IMPROVER IN A HYDROCARBON COMPOSITION INNOSPEC LTD (GB) 2020-04-01 EP disclosed
EP-2102317-B1 ADDITIVE, FUEL COMPOSITION, METHOD AND USE INNOSPEC LTD (GB) 2018-10-17 EP disclosed
EP-3080079-B1 OXIDATION OF 2-MERCAPTOETHANOL BASF SE (DE) 2018-07-25 EP disclosed
EP-2287277-B1 Composition INNOSPEC DEUTSCHLAND GMBH (DE) 2017-11-15 EP disclosed
EP-1899440-B1 FUEL COMPOSITION INNOSPEC DEUTSCHLAND GMBH (DE) 2016-06-15 EP disclosed
EP-0375303-A1 Engine cleaning additives for diesel fuel VELINO VENTURES INC. (CA) 1990-06-27 EP disclosed
EP-0359390-A1 Improved combustion of liquid hydrocarbons VELINO VENTURES INC. (CA) 1990-03-21 EP disclosed
US-4908045-A Burning fuel oil containing ferrocene derivatives in diesel engines in the presence of excess air; lowers nitrogen oxide emissions VELINO VENTURES, INC. (CA) 1990-03-13 US disclosed
EP-0346100-A1 Combustion of carbon containing materials in a furnace VELINO VENTURES INC. (CA) 1989-12-13 EP disclosed
US-4139349-A DICYCLOPENTADIENYL IRON, CYCLOPENTADIENYL MANGANESE TRICARBONYL E. I. DU PONT DE NEMOURS & CO. (US) 1979-02-13 US disclosed
US-3989731-A Production of dimers of dicyclopentadienyl iron compounds SYNTEX CORPORATION (PM) 1976-11-02 US disclosed