SCHEMBL449044

SCHEMBL449044

C[C]1C(C)=C(C)C(C)=C1C

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
SCHEMBL17581108 0.87
SCHEMBL11218164 0.79 ACHE (0.30)
SCHEMBL11218163 0.79 ACHE (0.30)
SCHEMBL18205013 0.79
SCHEMBL3688372 0.59
SCHEMBL1468768 0.53
SCHEMBL17581054 0.50
Hexamethylbenzene SCHEMBL114857 0.47 RXFP1 (0.33)
Hexamethylbenzene SCHEMBL8980194 0.43 RXFP1 (0.31)
Hexamethylbenzene SCHEMBL3853890 0.43 RXFP1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3966217-B1 CATIONIC GERMANIUM (II) COMPOUNDS, PROCESS FOR PREPARING SAME, AND THEIR USE AS CATALYSTS IN HYDROSILYLATION WACKER CHEMIE AG (DE) 2023-08-02 EP claimed
CN-116217352-A Method for preparing cannabigerol and analogues thereof 上海中医药大学 2023-06-06 CN claimed
WO-2023083828-A1 METHOD FOR PREPARING A CYCLIC ANHYDRIDE FROM AN UNSATURATED CARBOXYLIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2023-05-19 WO claimed
EP-3966217-A1 CATIONIC GERMANIUM (II) COMPOUNDS, PROCESS FOR PREPARING SAME, AND THEIR USE AS CATALYSTS IN HYDROSILYLATION Wacker Chemie AG (DE) 2022-03-16 EP claimed
WO-2020228922-A1 CATIONIC GERMANIUM (II) COMPOUNDS, PROCESS FOR PREPARING SAME, AND THEIR USE AS CATALYSTS IN HYDROSILYLATION WACKER CHEMIE AG (DE) 2020-11-19 WO claimed
CN-111825508-A Preparation method of dihydro 9-phenanthrene amine compound and chiral product prepared by same 中国科学院化学研究所 2020-10-27 CN claimed
CN-108250250-B Complex containing 1,1, 1-triphenyl-N- (1- (pyridine-2-) methylene) methylamine, preparation method and application 曲阜师范大学 2020-05-26 CN claimed
US-10450272-B2 Homogeneous process for hydrodehalogenating halogenated heteroaryl compounds JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-10-22 US claimed
US-20180334433-A1 HOMOGENEOUS PROCESS FOR HYDRODEHALOGENATING HALOGENATED HETEROARYL COMPOUNDS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2018-11-22 US claimed
US-9994647-B2 Metal complex with a cyclic amidine ligand ARLANXEO NETHERLANDS B.V. (NL) 2018-06-12 US claimed
CN-1157427-C Polymerization method for olefrines �����ɷ� 2004-07-14 CN claimed
US-20040030197-A1 Process for the synthesis of phenols from arenes BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2004-02-12 US claimed
US-20040024237-A1 Synthesis of aminoarylboronic esters and substituted anilines from arenes via catalytic C-H activation/borylation/amination and uses thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2004-02-05 US claimed
US-6444605-B1 REACTING A REACTION PRODUCT OF A MAGNESIUM ALKOXIDE OR ARYLOXIDE AND A GROUP IVB METAL ALKOXIDE OR ARYLOXIDE; AND A CYCLIC OR POLYCYCLIC HYDROCARBON; PREPARING POLYOLEFINS WITH BROAD OR BIMODAL MOLECULAR WEIGHT DISTRIBUTION UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2002-09-03 US claimed
US-6399531-B1 COORDINATION CATALYST UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2002-06-04 US claimed
EP-0685485-B1 High activity ethylene selective metallocenes PHILLIPS PETROLEUM CO (US) 2000-08-16 EP claimed
CN-1260807-A Polymerization method for olefrines BOREALL AS (DK) 2000-07-19 CN claimed
EP-0559885-B1 CATALYSTS AND PROCESS FOR THE PREPARATION OF SAME FOR USE IN THE POLYMERISATION OF ETHYLENE ENICHEM POLYMERES FRANCE (FR) 1996-04-10 EP claimed
US-5492983-A COORDINATION CATALYST ECP ENICHEM POLYMERES FRANCE (FR) 1996-02-20 US claimed
EP-0685485-A1 High activity ethylene selective metallocenes PHILLIPS PETROLEUM COMPANY (US) 1995-12-06 EP claimed