SCHEMBL72671

SCHEMBL72671

CC[C](CC)CC

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
SCHEMBL28328628 1.00
Water SCHEMBL27872089 0.94
SCHEMBL23581601 0.94
SCHEMBL25167175 0.82
SCHEMBL1684361 0.75
SCHEMBL1043058 0.75
SCHEMBL217230 0.72
SCHEMBL2780043 0.71
SCHEMBL8910918 0.71
SCHEMBL138692 0.71

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

Appears in 4405 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024126086-A1 IMPROVED PROCESS FOR PREPARING METAL ALKOXIDE COMPOUNDS EVONIK OPERATIONS GMBH (DE) 2024-06-20 WO claimed
WO-2024125775-A1 IMPROVED PROCESS FOR THE PREPARATION OF METAL ALCOHOLATE COMPOUNDS EVONIK OPERATIONS GMBH (DE) 2024-06-20 WO claimed
WO-2024120883-A1 IMPROVED PROCESS FOR PREPARING METAL ALKOXIDE COMPOUNDS EVONIK OPERATIONS GMBH (DE) 2024-06-13 WO claimed
CN-118087281-A Static electricity eliminating artificial leather 昆山阿基里斯新材料科技有限公司 2024-05-28 CN claimed
US-20240166595-A1 PROCESS FOR THE PREPARATION OF BENZOXAZEPIN OXAZOLIDINONE COMPOUNDS GENENTECH, INC. (US) 2024-05-23 US claimed
WO-2024083336-A1 IMPROVED PROCESS FOR PRODUCTION OF ALKALI METAL METHOXIDES EVONIK OPERATIONS GMBH (DE) 2024-04-25 WO claimed
WO-2024083322-A1 IMPROVED METHOD FOR THE DEPOLYMERISATION OF POLYETHYLENE TEREPHTHALATE EVONIK OPERATIONS GMBH (DE) 2024-04-25 WO claimed
EP-4347574-A1 PROCESS FOR THE PREPARATION OF BENZOXAZEPIN OXAZOLIDINONE COMPOUNDS Genentech, Inc. (US) 2024-04-10 EP claimed
CN-115710349-B Aliphatic-aromatic copolyester and application thereof 聚碳氧联新材料科技(无锡)有限公司 2024-02-20 CN claimed
CN-117447766-A Recycling method of waste ultra-high molecular weight polyethylene and application of waste ultra-high molecular weight polyethylene in rotational molding packaging box 湖北航天长征装备有限公司 2024-01-26 CN claimed
WO-1990005794-A1 TANNIN MANNICH ADDUCTS FOR IMPROVING CORROSION RESISTANCE OF METALS HENKEL CORPORATION (US) 1990-05-31 WO claimed
EP-0302588-A2 Formaldehyde-free binder for nonwoven fabrics REICHHOLD CHEMICALS, INC. (US) 1989-02-08 EP claimed
CN-88101833-A The synthetic method of substituted pyrazolecarboxylic 1988-10-19 CN claimed
EP-0286279-A1 Synthesis of substituted pyrazoles ELI LILLY AND COMPANY (US) 1988-10-12 EP claimed
US-4450171-A 6-/8-ACYLOXY/POLYHYDRONAPHTH-1-YL/ETHYLENE/ TETRAHYDRO-2H-PYRAN-2- ONE MERCK & CO., INC. (US) 1984-05-22 US claimed
US-4312818-A CATALYZED REACTION OF A PHENOL WITH A PHOSPHORUS HALIDE CIBA-GEIGY CORPORATION (US) 1982-01-26 US claimed
US-4304684-A Novel trialkyl aluminum cocatalyst EXXON RESEARCH & ENGINEERING CO. (US) 1981-12-08 US claimed
EP-0033538-A2 6(R)-(2-(8'-acyloxy-2'-methyl-6'-methyl (or hydrogen)-polyhydronaphthyl-1')-ethyl)-4(R)-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-ones, the hydroxy acid form of said pyranones, the pharmaceutically acceptable salts of said hydroxy acids, and the lower alkyl, and phenyl, dimethylamino or acetylamino substituted lower alkyl esters of said hydroxy acid, processes for preparing the same, and a pharmaceutical antihypercholesterolemic composition containing the same MERCK & CO. INC. (US) 1981-08-12 EP claimed
EP-0015762-A1 Ziegler type catalyst composition EXXON RESEARCH AND ENGINEERING COMPANY (US) 1980-09-17 EP claimed
US-4133648-A ALKANEDIOLS GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-01-09 US claimed