SCHEMBL1822679

SCHEMBL1822679

CC(C)(C)C1=CCC=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
SCHEMBL16821938 0.93
SCHEMBL4623006 0.89
SCHEMBL9452182 0.74
SCHEMBL1134420 0.74
Hydrochloric Acid SCHEMBL8850065 0.74
SCHEMBL3292052 0.65 MAPT (0.37)
SCHEMBL23914118 0.62
SCHEMBL6480567 0.62
SCHEMBL14752569 0.62
SCHEMBL22867359 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670681-A Process for preparing a carbon-bridged biscyclopentadiene compound HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US claimed
CN-107312045-B Preparation method of substituted cyclopentadienyl metallocene compound 上海化工研究院有限公司 2019-12-13 CN disclosed
CN-107312045-A A kind of preparation method of substituted cyclopentadienyl metallocene compound 上海化工研究院有限公司 2017-11-03 CN disclosed
CN-103459405-B Process for producing transition metal complex, catalyst for trimerization, process for producing 1-hexene, process for producing substituted cyclopentadiene compound (1) 住友化学株式会社 2016-09-28 CN disclosed
CN-103459406-B For the preparation of the method for transition metal complex, for the catalyzer of trimerization, for the preparation of the method for 1-hexene, for the preparation of the method (2) of the cyclopentadiene compound replaced SUMITOMO CHEMICAL CO.,LTD. (JP) 2016-03-16 CN disclosed
US-20110196103-A1 PROPYLENE COPOLYMER, POLYPROPYLENE COMPOSITION AND USES THEREOF, TRANSITION METAL COMPOUND AND OLEFIN POLYMERIZATION CATALYST MITSUI CHEMICALS, INC. (US) 2011-08-11 US disclosed
EP-1854804-B1 Heterocyclic metallocene compounds and use thereof in catalyst systems for producing olefin polymers BASELL POLYOLEFINE GMBH (DE) 2011-05-04 EP disclosed
US-7767313-B2 Polypropylene composite film comprising a metallocene-catalyzed propylene/1-butene random copolymer MITSUI CHEMICALS, INC. (JP) 2010-08-03 US disclosed
US-7737239-B2 Propylene copolymer, polypropylene composition and uses thereof, transition metal compound and olefin polymerization catalyst MITSUI CHEMICALS, INC. (JP) 2010-06-15 US disclosed
US-7728078-B2 Blend of a polypropylene and a elastomeric copolymer of 60-90 mol % propylene units and 10- 40 mol % of 1-butene units; sheets and films with excellent flexibility and impact resistance as well as sufficient heat resistance and low-temperature heat-sealability MITSUI CHEMICALS, INC. (JP) 2010-06-01 US disclosed
WO-1998051716-A1 PROCESS FOR PREPARING TACTIOSELECTIVE POLYOLEFINS IN CONDENSED PHASE USING HAFNOCENES MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-11-19 WO disclosed
WO-1998050440-A1 PROCESS FOR PRODUCING TACTIOSELECTIVE POLYOLEFINS IN CONDENSED PHASE USING TITANOCENES MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-11-12 WO disclosed
EP-0868440-A1 PROCESS FOR PRODUCING ETHYLENE COPOLYMERS UNDER HIGH PRESSURE BASF AKTIENGESELLSCHAFT (DE) 1998-10-07 EP disclosed
EP-0832866-A2 Process for the preparation of methylene-bridged biscyclopentadienyl compounds TARGOR GmbH (DE) 1998-04-01 EP disclosed
US-5703257-A Synthesis of cyclopentadienyl metal coordination complexes from metal hydrocarbyloxides THE DOW CHEMICAL COMPANY (US) 1997-12-30 US disclosed
US-5670681-A Process for preparing a carbon-bridged biscyclopentadiene compound HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US disclosed
WO-1997014724-A1 PROCESS FOR PRODUCING ETHYLENE COPOLYMERS UNDER HIGH PRESSURE BASF AKTIENGESELLSCHAFT (DE) 1997-04-24 WO disclosed
EP-0751143-A2 Process for the preparation of carbon bridged dicyclopentadiene compounds HOECHST AKTIENGESELLSCHAFT (DE) 1997-01-02 EP disclosed
US-5504223-A Synthesis of cyclopentadienyl metal coordination complexes from metal hydrocarbyloxides THE DOW CHEMICAL COMPANY (US) 1996-04-02 US disclosed
WO-1994022846-A1 COMPOUNDS ENHANCING ANTITUMOR ACTIVITY OF OTHER CYTOTOXIC AGENTS PFIZER INC. (US) 1994-10-13 WO disclosed