SCHEMBL5322644

SCHEMBL5322644

CC(C)(C)c1cc(COC(=O)CC(=O)O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.41
NR5A1 Q13285 1/20 0.41
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
XBP1 P17861 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLRA3 O75311 1/20 0.38
GLRB P48167 1/20 0.38
CYP2C19 P33261 4/20 0.38
CYP2C9 P11712 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGS2 P35354 1/20 0.38
GPR55 Q9Y2T6 1/20 0.37
VCAM1 P19320 3/20 0.37
CD69 Q07108 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
SCHEMBL7597579 0.93 NR5A2 (0.44) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL6057810 0.82 ALDH1A1 (0.42) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL3125775 0.80 GAA (0.47) ALDH1A1GAAMAPK1NPSR1GLRA3
SCHEMBL7649243 0.78 CYP2C19 (0.39) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL5083341 0.78 CYP1A2 (0.42) ALDH1A1GAAMAPK1HTTNPSR1
SCHEMBL5605119 0.77 RXRA (0.48) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL6057485 0.76 ALDH1A1 (0.46) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL265814 0.75 NR1H4 (0.48) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL30206727 0.75 NR1H4 (0.48) NR5A2NR5A1ALDH1A1GAAXBP1
SCHEMBL8854376 0.74 VCAM1 (0.48) NR5A2NR5A1ALDH1A1GAAXBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117203271-A Use of a stabilizer composition for stabilizing halogen-free thermoplastic recycling material, a stabilizer composition, a masterbatch or concentrate, a stabilized plastic composition, a method for stabilizing halogen-free thermoplastic recycling material and use of a composition 弗劳恩霍夫应用研究促进协会 2023-12-08 CN claimed
CN-115461396-B Additive composition and use thereof, condensation polymer composition, molding compound prepared from same and molded part and use thereof 弗劳恩霍夫应用研究促进协会 2024-07-12 CN disclosed
CN-118234793-A Stabilizer based on syringic acid, vanillic acid, isovanillic acid or 5-hydroxyveratric acid, plastic composition, method for stabilizing a plastic composition and stabilizer composition 弗劳恩霍夫应用研究促进协会 2024-06-21 CN disclosed
CN-118063856-A Flame retardant mixtures 科莱恩国际有限公司 2024-05-24 CN disclosed
CN-117999310-A Stabilizer formulation 巴斯夫欧洲公司 2024-05-07 CN disclosed
CN-117897427-A Stabilizer combinations for preventing degradation of synthetic polymers 巴斯夫欧洲公司 2024-04-16 CN disclosed
CN-113166467-B Polyethylene or polypropylene articles 巴斯夫欧洲公司 2024-03-29 CN disclosed
CN-117715965-A Improved polymer compositions 杜邦聚合物公司 2024-03-15 CN disclosed
CN-117677658-A Additive mixture for stabilizing organic materials 巴斯夫欧洲公司 2024-03-08 CN disclosed
CN-117642406-A Phenol compound, stabilizer for organic material, resin composition, and method for stabilizing organic material 住友化学株式会社 2024-03-01 CN disclosed
CN-1531567-A Polycarbonates with significant shear thinning behavior 2004-09-22 CN disclosed
CN-1501952-A Polycarbonates having a low shear thinning ratio 2004-06-02 CN disclosed
CN-1486269-A Antistatic flexible intermediate bulk container �������⻯ѧƷ�ع����޹�˾ 2004-03-31 CN disclosed
CN-1437630-A Stabilizer mixture CIBA SC HOLDING AG (CH) 2003-08-20 CN disclosed
US-20020065201-A1 Lubricants with 5-tert.-butyl-4-hydroxy-3-methylphenyl substituted fatty acid esters CIBA SPECIALTY CHEMICALS CORP. 2002-05-30 US disclosed
EP-1110999-A2 Stabilizing mixtures for organic polymers Great Lakes Chemical (Europe) GmbH (CH) 2001-06-27 EP disclosed
WO-2000008096-A1 STABILIZING MIXTURE HAVING A MELTING POINT LOWER THAN THAT OF THE HIGHEST MELTING COMPONENT GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2000-02-17 WO disclosed
CN-1040208-C 3-(2-acyloxyethoxyphenyl) benzofuran-2-ones for use as stabilizers SPECIALTY CHEMICALS HOLDING IN (CH) 1998-10-14 CN disclosed
CN-1135477-A Diphenolic ester derivative CIBA GEIGY AG (CH) 1996-11-13 CN disclosed
CN-1132763-A Low-dust granules of plastic additives CIBA GEIGY AG (CH) 1996-10-09 CN disclosed