SCHEMBL791569

SCHEMBL791569

COc1cccc(OCc2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 1.00
APP P05067 1/20 0.72
MRGPRX4 Q96LA9 1/20 0.67
BCHE P06276 4/20 0.66
ABCB1 P08183 1/20 0.60
HTR1A P08908 1/20 0.60
DRD2 P14416 1/20 0.60
CYP4F2 P78329 1/20 0.59
CYP4A11 Q02928 1/20 0.59

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
Ethylene Glycol SCHEMBL29003668 0.93 MAOB (0.87) MAOBAPPMRGPRX4BCHEABCB1
SCHEMBL1268719 0.90 MAOB (0.81) MAOBBCHECYP4F2CYP4A11
SCHEMBL13263642 0.89 MAOB (0.79) MAOBMRGPRX4BCHEABCB1HTR1A
SCHEMBL28182081 0.88 MAOB (0.79) MAOBAPPBCHECYP4F2CYP4A11
SCHEMBL23906959 0.88 MAOB (0.79) MAOBAPPMRGPRX4BCHEABCB1
Benzylphenylether SCHEMBL28164613 0.86 MAOB (0.75) MAOBAPPMRGPRX4BCHEABCB1
SCHEMBL27252705 0.85 MAOB (0.74) MAOBAPPMRGPRX4BCHECYP4F2
SCHEMBL13434095 0.85 MAOB (0.73) MAOBMRGPRX4BCHECYP4F2CYP4A11
SCHEMBL5329319 0.84 MAOB (0.72) MAOBBCHECYP4F2CYP4A11
SCHEMBL28237963 0.84 MAOB (0.72) MAOBBCHECYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115980372-A High-specificity high-density lipoprotein PEG-cyclodextrin sulfate system additive 东软威特曼生物科技(南京)有限公司 2023-04-18 CN claimed
CN-115980372-A High-specificity high-density lipoprotein PEG-cyclodextrin sulfate system additive 东软威特曼生物科技(南京)有限公司 2023-04-18 CN disclosed
CN-115980372-A High-specificity high-density lipoprotein PEG-cyclodextrin sulfate system additive 东软威特曼生物科技(南京)有限公司 2023-04-18 CN disclosed
CN-105849111-B Pyrans and the different cresol derivatives of baynide fibre and metabolic syndrome or treatment of inflammatory diseases pharmaceutical composition 格拉斯如睦株式会社 2018-05-04 CN disclosed
CN-103108866-B cyclohexane derivative compound DAIICHI SANKYO Co.,Ltd. (JP) 2015-09-09 CN disclosed
EP-2683703-B1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI SA (FR) 2015-05-27 EP disclosed
EP-2683703-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2014-01-15 EP disclosed
CN-103108866-A Cyclohexane derivative compound DAIICHI SANKYO CO LTD 2013-05-15 CN disclosed
EP-2513053-A1 PYRROLIDINE OR THIAZOLIDINE CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERSAS AS AGONISTS OF G- PROTEIN COUPLED RECEPTOR 43 (GPR43) Euroscreen S.A. (BE) 2012-10-24 EP disclosed
WO-2012120057-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2012-09-13 WO disclosed
EP-0011370-A1 Process for preparing 2-chlorosulfinyl-azetidinones ELI LILLY AND COMPANY (US) 1980-05-28 EP disclosed
US-4165315-A CHLORINATION WITH AN N-CHLORO HALOGENATING AGENT ELI LILLY AND COMPANY (US) 1979-08-21 US disclosed
US-4165316-A Process for preparing sulfinyl chlorides from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1979-08-21 US disclosed
US-4159272-A Process for 2-chlorosulfinylazetidin-4-ones ELI LILLY AND COMPANY (US) 1979-06-26 US disclosed
US-4115383-A Alkoxycarbonyl-ethylthio-azetidinones and process for their preparation ELI LILLY AND COMPANY (US) 1978-09-19 US disclosed
US-4081440-A Sulfinyl halides and their preparation from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-03-28 US disclosed
US-4075203-A Process for preparing a 3-exomethylenecepham sulfoxide from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-02-21 US disclosed
US-4048162-A Process for preparing 3-hydroxy cephalosporins ELI LILLY AND COMPANY (US) 1977-09-13 US disclosed
US-4008230-A Process for preparing 3-hydroxy cephalosporins ELI LILLY AND COMPANY (US) 1977-02-15 US disclosed
US-4008231-A Preparation of 3-methoxymethylcephalosporins ELI LILLY AND COMPANY (US) 1977-02-15 US disclosed