SCHEMBL183121

SCHEMBL183121

CCCCCC1CCC2=C(C1)C(=O)c1ccccc1C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
PTPN1 P18031 2/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD2 P14416 1/20 0.38
CHRM3 P20309 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
AKT1 P31749 2/20 0.38
SOAT1 P35610 9/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL11878454 0.96 CYP1A2 (0.39) CYP1A2PTPN1CHRM2CHRM4CHRM5
SCHEMBL28281311 0.90 AKT1 (0.40) CHRM2CHRM4CHRM5CHRM1DRD2
SCHEMBL28311356 0.87 NPC1 (0.46) CYP1A2PTPN1DRD2AKT1MEN1
SCHEMBL2207857 0.84 DHODH (0.35) CYP1A2PTPN1AKT1MEN1NPC1
SCHEMBL183347 0.83 LMNA (0.39) CYP1A2AKT1MEN1NPC1ALDH1A1
SCHEMBL30393799 0.83 LMNA (0.39) CYP1A2AKT1MEN1NPC1ALDH1A1
Anthraquinone SCHEMBL28278072 0.82 LMNA (0.41) AKT1MEN1NPC1ALDH1A1MAPT
SCHEMBL7614359 0.77 MAPT (0.39) CYP1A2DRD3MEN1ALDH1A1MAPT
SCHEMBL5955631 0.74 CASP3 (0.40) PTPN1AKT1MEN1NPC1ALDH1A1
SCHEMBL15353111 0.73 AKT1 (0.38) PTPN1AKT1SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117451874-A Analysis method of multicomponent working solution for preparing hydrogen peroxide by anthraquinone process 宜昌苏鹏科技有限公司 2024-01-26 CN claimed
CN-115924853-B High-yield working liquid system for producing hydrogen peroxide by anthraquinone process 黎明化工研究设计院有限责任公司 2024-01-05 CN claimed
CN-113351240-B Supported palladium catalyst and preparation method and application thereof 中国石油化工股份有限公司 2023-12-15 CN claimed
CN-115924853-A High-energy-yield working liquid system for producing hydrogen peroxide by anthraquinone process 黎明化工研究设计院有限责任公司 2023-04-07 CN claimed
CN-115504437-A Preparation method and application of hydrogen peroxide 中国石油化工股份有限公司 2022-12-23 CN claimed
CN-110562931-B Method for improving hydrogenation rate and hydrogen peroxide yield of alkyl anthraquinone derivative 天津大学 2022-11-04 CN claimed
CN-108264455-B Method for preparing tetrahydro-2-amylanthraquinone and method for producing hydrogen peroxide 中国石油化工股份有限公司 2021-11-12 CN claimed
CN-113351240-A Supported palladium catalyst and preparation method and application thereof 中国石油化工股份有限公司 2021-09-07 CN claimed
CN-110562931-A Method for improving hydrogenation rate and hydrogen peroxide yield of alkyl anthraquinone derivative 天津大学 2019-12-13 CN claimed
CN-106629622-B A kind of method for hydrogenation and hydrogenation apparatus of hydrogeneous anthraquinone working solution 中触媒新材料股份有限公司 2019-02-22 CN claimed
EP-0126319-A2 Purification of alkylated anthraquinones FMC Corporation (US) 1984-11-28 EP claimed
US-4046868-A FROM AN ANTHRAQUINONE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-06 US claimed
CN-122059817-A Preparation method of 2-alkyl tetrahydroanthraquinone and application of 2-alkyl tetrahydroanthraquinone in hydrogen peroxide process 黎明化工研究设计院有限责任公司 2026-05-19 CN disclosed
CN-119455935-A Palladium-based hydrogenation catalyst, preparation method thereof and application thereof in hydrogen peroxide production by anthraquinone process 山东能源集团煤气化新材料科技有限公司 2025-02-18 CN disclosed
CN-111620309-B Regeneration method and regeneration device for working solution for producing hydrogen peroxide by anthraquinone process 黎明化工研究设计院有限责任公司 2024-02-27 CN disclosed
CN-117451874-A Analysis method of multicomponent working solution for preparing hydrogen peroxide by anthraquinone process 宜昌苏鹏科技有限公司 2024-01-26 CN disclosed
EP-0597890-A1 REMOVAL OF HYDROGEN SULPHIDE. SOLVAY INTEROX LTD (GB) 1994-05-25 EP disclosed
EP-0590709-A1 Stabilized compositions containing hydrofluoroalkanes, premixtures for the preparation of polymeric foams and polymeric foams obtained thereby SOLVAY (Société Anonyme) (BE) 1994-04-06 EP disclosed
WO-1993002961-A1 REMOVAL OF HYDROGEN SULPHIDE SOLVAY INTEROX LIMITED (GB) 1993-02-18 WO disclosed
EP-0158864-B1 PROCESS FOR HYDROGENATING AN ALKYLATED ANTHRAQUINONE FMC Corporation (US) 1989-01-25 EP disclosed