SCHEMBL168554

SCHEMBL168554

CCc1cc(CC)c(CC)c(CC)c1CC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.36
GRIN3B O60391 3/20 0.36
GRIN1 Q05586 3/20 0.36
GRIN2A Q12879 3/20 0.36
GRIN2B Q13224 3/20 0.36
GRIN2C Q14957 3/20 0.36
GRIN3A Q8TCU5 3/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
DHFR P00374 1/20 0.34
GABRA1 P14867 3/20 0.33
GABRB2 P47870 3/20 0.33
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL27455415 0.97 GRIN2D (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5178615 0.97 GRIN2D (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Ethylene SCHEMBL27743149 0.94 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10482166 0.87 NOS3 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL598635 0.84 NOS3 (0.33) NOS3NOS1NOS2SMN1; SMN2DHFR
Ammonia Solution, Strong SCHEMBL1338664 0.84 PON1 (0.30) SMN1; SMN2
SCHEMBL11475040 0.84 SMN1; SMN2 (0.30) SMN1; SMN2
Bromide SCHEMBL8152930 0.84 NOS3 (0.33) NOS3NOS1NOS2SMN1; SMN2DHFR
SCHEMBL294102 0.83 NOS3 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31123394 0.83 NOS3 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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 717 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
US-12139627-B2 Perovskite ink formulations EXCYTON LIMITED (GB) 2024-11-12 US 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
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
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
CN-109749758-B Tar quality improvement treatment method 中国科学院过程工程研究所 2021-04-30 CN claimed
CN-109749758-A A kind of upgrading processing method of tar 中国科学院过程工程研究所 2019-05-14 CN claimed
US-9120715-B2 Alkylation of aromatic substrates TOTAL PETROCHEMICALS FRANCE (FR) 2015-09-01 US claimed
US-20140206917-A1 Alkylation of Aromatic Substrates TOTAL PETROCHEMICALS FRANCE (FR) 2014-07-24 US claimed
US-5210355-A Ethylation of 2-methylnaphthalene with tri-, tetra-, or penta-ethylbenzene in the presence of a catalyst AMOCO CORPORATION (US) 1993-05-11 US claimed
US-5171917-A Ethylation of benzene, toluene, ethylbenzene or a mixture of benzene and ethylbenzene with 1,2,4-triethylbenezene, tetra- or pentaethylbenzene in the presence of an acid catalys catalyst AMOCO CORPORATION (US) 1992-12-15 US claimed
EP-0494315-A1 PROCESS FOR PRODUCING 2-ALKYL-6-ETHYL-NAPHTHALENE NIPPON STEEL CHEMICAL CO., LTD. (JP) 1992-07-15 EP claimed
EP-0487714-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-06-03 EP claimed
WO-1992000260-A1 SELECTIVE ETHYLATION OF NAPHTHALENE COMPOUNDS AMOCO CORPORATION (US) 1992-01-09 WO claimed
US-5073655-A Alkylation of aromatic hydrocarbon with aromatic alklating hal ide, alcohol or olefin, a mixed oxide of silica or germania wi th alumina, boria, iron oxide or gallium oxide MOBIL OIL CORP. (US) 1991-12-17 US claimed
WO-1990000163-A1 SELECTIVE PRODUCTION OF 2,6-DIETHYLNAPHTHALENE AMOCO CORPORATION (US) 1990-01-11 WO claimed
EP-0349189-A1 Selective production of 2,6-diethyl-naphthalene AMOCO CORPORATION (US) 1990-01-03 EP claimed
US-4873386-A ETHYLATING AGENT, LEWIS ACID CATALYST AMOCO CORPORATION (US) 1989-10-10 US claimed
US-4014845-A Fugitive vehicle system OWENS-ILLINOIS, INC. (US) 1977-03-29 US claimed