SCHEMBL4657600

SCHEMBL4657600

CC(C)c1cccc2c(C(C)C)cccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.57
LMNA P02545 3/20 0.57
CYP1A2 P05177 3/20 0.57
GABRG2 P18507 2/20 0.57
GABRB3 P28472 2/20 0.57
GABRB2 P47870 2/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
FAAH O00519 2/20 0.57
CYP3A4 P08684 1/20 0.57
HPGD P15428 1/20 0.57
TSHR P16473 1/20 0.57
GABRB1 P18505 1/20 0.57
PTGS1 P23219 1/20 0.57
SLC6A2 P23975 1/20 0.57
HTR2C P28335 1/20 0.57
GABRA5 P31644 1/20 0.57
GABRA3 P34903 1/20 0.57
HTR2B P41595 1/20 0.57
GABRA2 P47869 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL30381967 1.00 GABRA1 (0.57) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL8781825 0.88 GABRA1 (0.48) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL30876294 0.88 GABRA1 (0.48) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL23735859 0.87 CYP1A2 (0.62) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL11975687 0.85 CYP1A2 (0.59) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL19111266 0.85 GABRA1 (0.44) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL15267174 0.85 GABRA1 (0.60) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL23618354 0.85 GABRA1 (0.44) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL19111267 0.85 CYP3A4 (0.59) GABRA1LMNACYP1A2GABRG2GABRB3
SCHEMBL66681 0.84 ALDH1A1 (0.60) GABRA1LMNACYP1A2GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240400784-A1 Method for Screening Solvent for Extracting Polyvinyl Chloride, Method for Recycling Waste, Recycled Polyvinyl Chloride, and Composition LG CHEM, LTD. (KR) 2024-12-05 US claimed
US-20240392094-A1 Method for Screening Solvent for Polyvinyl Chloride Extraction, Recycling Method for Waste Material, and Recycled Polyvinyl Chloride and Composition LG CHEM, LTD. (KR) 2024-11-28 US claimed
CN-118050418-A Ultrasonic atomization-hydrogen flame mass spectrum detection method for diisopropylnaphthalene compounds 湖南中烟工业有限责任公司 2024-05-17 CN claimed
CN-117897439-A Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-115960473-A Method for preparing metal phthalocyanine pigment by solvent method 江苏丽王科技股份有限公司 2023-04-14 CN claimed
WO-2023033601-A1 METHOD FOR SCREENING SOLVENT FOR POLYVINYL CHLORIDE EXTRACTION, RECYCLING METHOD FOR WASTE MATERIAL, AND RECYCLED POLYVINYL CHLORIDE AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO claimed
WO-2023033605-A1 METHOD FOR SCREENING SOLVENT FOR EXTRACTING POLYVINYL CHLORIDE, METHOD FOR RECYCLING WASTE, RECYCLED POLYVINYL CHLORIDE, AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO claimed
CN-111308003-B Method for simultaneously detecting diisopropylnaphthalenes, polychlorinated biphenyls, phthalate compounds and photoinitiator 福建中烟工业有限责任公司 2022-11-08 CN claimed
CN-111308003-A Method for simultaneously detecting diisopropylnaphthalenes, polychlorinated biphenyls, phthalate compounds and photoinitiator 福建中烟工业有限责任公司 2020-06-19 CN claimed
US-4900717-A USEFUL IN THE PREPARATION OF NAPHTHALENEDICARBOXYLIC ACID/2,6-/ RUTGERSWERKE AG (DE) 1990-02-13 US claimed
EP-0216009-B1 PROCESS FOR RECOVERING 2,6-DIALKYL ISOMERS OF NAPHTHALENE FROM THEIR MIXTURES OF ISOMERS RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1988-10-05 EP claimed
EP-0216009-A1 Process for recovering 2,6-dialkyl isomers of naphthalene from their mixtures of isomers RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1987-04-01 EP claimed
JP-3087289-A None JP disclosed
US-20240400784-A1 Method for Screening Solvent for Extracting Polyvinyl Chloride, Method for Recycling Waste, Recycled Polyvinyl Chloride, and Composition LG CHEM, LTD. (KR) 2024-12-05 US disclosed
US-20240392094-A1 Method for Screening Solvent for Polyvinyl Chloride Extraction, Recycling Method for Waste Material, and Recycled Polyvinyl Chloride and Composition LG CHEM, LTD. (KR) 2024-11-28 US disclosed
US-4752784-A Thermal electrostatic ink-jet recording method FUJI XEROX CO., LTD. (JP) 1988-06-21 US disclosed
EP-0240597-A1 Solvent, ink and coated paper for carbonless copying system KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-10-14 EP disclosed
EP-0216009-A1 Process for recovering 2,6-dialkyl isomers of naphthalene from their mixtures of isomers RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1987-04-01 EP disclosed
US-RE29459-E CATALYTIC ISOMERIZATION CHEVRON RESEARCH COMPANY (US) 1977-10-25 US disclosed