SCHEMBL7422191

SCHEMBL7422191

Cc1ccc(C)c(C2CCCCC2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.50
PSMB5 P28074 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38

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
P-Xylene SCHEMBL9420802 0.98 PTGDR2 (0.49) PTGDR2PSMB5NPC1RAB9ADRD2
SCHEMBL19308494 0.98 PTGDR2 (0.47) PTGDR2PSMB5NPC1RAB9ADRD2
SCHEMBL16956272 0.89 DRD2 (0.47) PTGDR2NPC1DRD2DRD4DRD3
SCHEMBL1128140 0.83 PSMB5 (0.47) PTGDR2PSMB5NPC1RAB9ACHRNB2
SCHEMBL25574304 0.83 PTGDR2 (0.39) PTGDR2PSMB5NPC1RAB9ADRD2
SCHEMBL11277728 0.82 ACMSD (0.42) PSMB5KDM4EALDH1A1TP53KMT2A
SCHEMBL11295388 0.81 PSMB5 (0.45) PTGDR2PSMB5NPC1RAB9ACHRNB2
SCHEMBL9785240 0.80 PTGDR2 (0.41) PTGDR2PSMB5CHRNB2CHRNA4ALDH1A1
SCHEMBL28464976 0.80 PTGDR2 (0.48) PTGDR2PSMB5
SCHEMBL10455337 0.80 NUDT1 (0.54) PTGDR2PSMB5NPC1RAB9ACHRNB2

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107438590-A The cyclohexyl benzyl and biphenol compound of transfering alkylation 埃克森美孚化学专利公司 2017-12-05 CN claimed
CN-108884001-A The production of methyl substituted biphenol compound 埃克森美孚化学专利公司 2018-11-23 CN disclosed
CN-106103388-B Hydroalkylation catalyst and process for its use 埃克森美孚化学专利公司 2018-08-14 CN disclosed
CN-105008314-B Methyl substituted biphenol compound, their preparation and their purposes in plasticizer is manufactured 埃克森美孚化学专利公司 2018-03-16 CN disclosed
CN-107438590-A The cyclohexyl benzyl and biphenol compound of transfering alkylation 埃克森美孚化学专利公司 2017-12-05 CN disclosed
CN-107428630-A The production of biphenol compound 埃克森美孚化学专利公司 2017-12-01 CN disclosed
CN-107081173-A Carbon monoxide-olefin polymeric for hydroformylation and the hydroformylation process using the carbon monoxide-olefin polymeric LG化学株式会社 2017-08-22 CN disclosed
CN-106103388-A Hydroalkylation catalyst and process for its use 埃克森美孚化学专利公司 2016-11-09 CN disclosed
CN-105050985-A Methyl-substituted biphenyl compounds, their production and their use in the manufacture of plasticizers EXXONMOBIL CHEM PATENTS INC 2015-11-11 CN disclosed
CN-105026341-A Methyl-substituted biphenyl compounds, their preparation and their use for producing plasticizers EXXONMOBIL CHEM PATENTS INC 2015-11-04 CN disclosed
CN-105008314-A Methyl-substituted biphenyl compounds, their production and their use in manufacture of plasticizers EXXONMOBIL CHEM PATENTS INC 2015-10-28 CN disclosed
WO-2013101478-A1 CATALYST SYSTEMS FOR PRODUCTION OF ALPHA OLEFIN OLIGOMERS AND POLYMERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2013-07-04 WO disclosed
WO-2001007027-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL DISEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-02-01 WO disclosed
EP-0655051-B1 PROCESS FOR PREPARING PHENYLTEREPHTHALIC ACID EASTMAN CHEM CO (US) 1998-04-15 EP disclosed
EP-0655051-A1 PROCESS FOR PREPARING PHENYLTEREPHTHALIC ACID EASTMAN CHEMICAL COMPANY (US) 1995-05-31 EP disclosed
EP-0655052-A1 PROCESS FOR PREPARING 2,5-DIPHENYLTEREPHTHALIC ACID EASTMAN CHEMICAL COMPANY (US) 1995-05-31 EP disclosed
US-5359134-A Alkylation of p-xylene with cyclohexane, dehydrogenation and oxidation and separation EASTMAN CHEMICAL COMPANY (US) 1994-10-25 US disclosed
US-5334754-A Process for preparing 2,5-diphenylterephthalic acid by oxidation EASTMAN CHEMICAL COMPANY (US) 1994-08-02 US disclosed
WO-1994004481-A1 PROCESS FOR PREPARING 2,5-DIPHENYLTEREPHTHALIC ACID EASTMAN CHEMICAL COMPANY (US) 1994-03-03 WO disclosed
WO-1994004480-A1 PROCESS FOR PREPARING PHENYLTEREPHTHALIC ACID EASTMAN CHEMICAL COMPANY (US) 1994-03-03 WO disclosed