SCHEMBL428658

SCHEMBL428658

CCC(C)(C)C(C)O

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
SCHEMBL16326319 1.00
SCHEMBL14980226 1.00
SCHEMBL11038466 0.77 TSHR (0.32)
SCHEMBL1104153 0.76
SCHEMBL8532705 0.75 TSHR (0.35)
SCHEMBL1658351 0.75
SCHEMBL10773007 0.75 TRPA1 (0.45)
SCHEMBL14401846 0.75 TRPA1 (0.45)
SCHEMBL16326318 0.73
SCHEMBL8032199 0.73 TSHR (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9670218-B2 Methods for making 3-O-protected morphinones and 3-O-protected morphinone dienol carboxylates PURDUE PHARMA L.P. (US) 2017-06-06 US claimed
US-20150239898-A1 METHODS FOR MAKING 3-O-PROTECTED MORPHINONES AND 3-O-PROTECTED MORPHINONE DIENOL CARBOXYLATES EURO-CELTIQUE S.A. (LU) 2015-08-27 US claimed
US-20240410055-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2024-12-12 US disclosed
US-12116468-B2 Composite particles comprising a hydrophobic dye and an amphiphilic block copolymer and use thereof in optical applications COLOURSMITH LABS INC. (CA) 2024-10-15 US disclosed
CN-118076767-A Method and formulation for producing an optical metal oxide layer 默克专利有限公司 2024-05-24 CN disclosed
US-11981817-B2 Hydrogen sulfide scavengers for asphalt ECOLAB USA INC. (US) 2024-05-14 US disclosed
CN-117683220-A Preparation method of hydrophilic plasticized polyvinyl chloride plastic 北京化工大学 2024-03-12 CN disclosed
EP-3539942-B1 METHOD FOR PRODUCING MENTHONES FROM ISOPULEGOL IN THE GAS PHASE BASF SE (DE) 2023-09-13 EP disclosed
EP-3551702-B1 HYDROGEN SULFIDE SCAVENGERS FOR POLYMER TREATED ASPHALT ECOLAB USA INC (US) 2023-06-14 EP disclosed
WO-2023057401-A1 METHOD AND FORMULATION FOR PREPARING OPTICAL METAL OXIDE LAYERS MERCK PATENT GMBH (DE) 2023-04-13 WO disclosed
US-20220235197-A1 COMPOSITE PARTICLES COMPRISING A HYDROPHOBIC DYE AND AN AMPHIPHILIC BLOCK COPOLYMER AND USE THEREOF IN OPTICAL APPLICATIONS COLOURSMITH LABS INC. (CA) 2022-07-28 US disclosed
US-4914116-A Nitrogen-containing heterocyclic compounds, and their use as insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-04-03 US disclosed
US-4847259-A Nitrogen-containing heterocyclic compounds, and use as insecticide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-07-11 US disclosed
US-4717494-A CHEMICAL REACTION OF A DICARBOXYLIC ACID ANHYDRIDE AND AN ALCOHOL UBE INDUSTRIES, LTD. (JP) 1988-01-05 US disclosed
US-4714706-A JUVENILE HORMONE INHIBITORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-12-22 US disclosed
EP-0203798-A2 Nitrogen-containing heterocyclic compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-03 EP disclosed
US-4490414-A ANTITUMOR AGENTS, SKIN DISORDER SRI INTERNATIONAL (US) 1984-12-25 US disclosed
US-4480131-A ALKYATION OF AMINE WITH ALCOHOL IN PRESENCE OF CATALYST LEHIGH UNIVERSITY (US) 1984-10-30 US disclosed
US-4224290-A RECOVERING ORGANIC HYPOHALITE AND ALKALI METAL HALIDE FROM AQUEOUS ALKALINE EARTH HALIDE AND HYPOHALITE OLIN CORPORATION (US) 1980-09-23 US disclosed
US-4177115-A ELECTROLYSIS OF BRINE AND ALCOHOL OLIN CORPORATION (US) 1979-12-04 US disclosed