Isopropylbenzene

Isopropylbenzene

SCHEMBL338185

CC(C)c1ccccc1.Cc1ccccc1

nearest known ligand 0.61

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
TSHR P16473 2/20 0.61
ALOX12 P18054 1/20 0.61
ACHE P22303 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.44
TAAR1 Q96RJ0 3/20 0.42
CNR2 P34972 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2C P18825 1/20 0.41
CYP2D6 P10635 1/20 0.41
HIF1A Q16665 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ACP3 P15309 1/20 0.39
ALDH1A1 P00352 1/20 0.39
DPP4 P27487 2/20 0.39
F2 P00734 1/20 0.39

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
Isopropylbenzene SCHEMBL3475008 1.00 LMNA (0.61) LMNATSHRALOX12ACHESMN1; SMN2
Toluene SCHEMBL29188898 0.94 LMNA (0.61) LMNATSHRALOX12ACHESMN1; SMN2
P-Cymene SCHEMBL10942903 0.92 ACHE (0.58) LMNATSHRALOX12ACHESMN1; SMN2
P-Cymene SCHEMBL1292746 0.92 ACHE (0.50) LMNATSHRALOX12ACHESMN1; SMN2
P-Cymene SCHEMBL8208471 0.92 ACHE (0.58) LMNATSHRALOX12ACHESMN1; SMN2
Isopropylbenzene SCHEMBL6568 0.88
Isopropylbenzene SCHEMBL8431863 0.88 TAAR1 (0.50) LMNATSHRTAAR1ADRA2AADRA2C
Isopropylbenzene SCHEMBL11254813 0.88
Isopropylbenzene SCHEMBL87809 0.88 TAAR1 (0.50) LMNATSHRTAAR1ADRA2AADRA2C
Isopropylbenzene SCHEMBL3672803 0.88 TAAR1 (0.50) LMNATSHRTAAR1ADRA2AADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097764-B2 Methods of isomerizing xylenes with a catalyst reduced in the presence of hydrogen and a base CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-01-17 US claimed
US-20110046428-A1 Methods of Isomerizing Xylenes with a Catalyst Reduced in the Presence of Hydrogen and a Base CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2011-02-24 US claimed
CN-1110628-A Preparation of silicon/magnesium-mixed rear-earth modified catalyzer and its appliance UNIV DALIAN SCIENCE & ENG (CN) 1995-10-25 CN claimed
CN-110002464-B Preparation method of MCM-49 molecular sieve, MCM-49 molecular sieve catalyst, preparation method and application thereof 中国石油天然气股份有限公司 2021-07-02 CN disclosed
CN-111836802-A Fungicidal acibenzoates 拜耳公司 2020-10-27 CN disclosed
CN-110002464-A Preparation method of MCM-49 molecular sieve, MCM-49 molecular sieve catalyst, preparation method and application thereof 中国石油天然气股份有限公司 2019-07-12 CN disclosed
CN-109735168-A Cycloalkane alcohol is preparing the application in quantum dot ink, quantum dot ink and preparation method thereof as additive 广东聚华印刷显示技术有限公司 2019-05-10 CN disclosed
US-8097764-B2 Methods of isomerizing xylenes with a catalyst reduced in the presence of hydrogen and a base CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-01-17 US disclosed
US-20110046428-A1 Methods of Isomerizing Xylenes with a Catalyst Reduced in the Presence of Hydrogen and a Base CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2011-02-24 US disclosed
US-7851664-B2 Methods of isomerizing xylenes with a catalyst reduced in the presence of hydrogen and a base CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2010-12-14 US disclosed
US-20090163752-A1 Methods of isomerizing xylenes with a catalyst reduced in the presence of hydrogen and a base CHEVRON PHILLIPS CHEMICAL COMPANY LP 2009-06-25 US disclosed
CN-1160402-C 'alpha'-olefin/aromatic vinyl copolymer composition and products thereof 三井化学株式会社 2004-08-04 CN disclosed
WO-2003087288-A1 DETERGENT GRANULE COMPRISING A NONIONIC SURFACTANT AND A HYDROTROPE THE PROCTER & GAMBLE COMPANY (US) 2003-10-23 WO disclosed
US-20030195134-A1 Detergent granule comprising a nonionic surfactant and a hydrotrope THE PROCTER & GAMBLE COMPANY 2003-10-16 US disclosed
EP-1352951-A1 Detergent granule comprising a nonionic surfactant and a hydrotrope The Procter & Gamble Company (US) 2003-10-15 EP disclosed
CN-1225671-A Detergent composition PROCTER & GAMBLE (US) 1999-08-11 CN disclosed
CN-1209827-A 'alpha'-olefin/aromatic vinyl copolymer composition and products thereof MITSUI CHEMICALS INC (JP) 1999-03-03 CN disclosed
WO-1998017752-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO disclosed
US-5705452-A AS DEVELOPER; HIGH SENSITIVITY, LOW BACKGROUND BLUSH DURING STORAGE, RESISTANCE TO HEAT, MOISTURE, PLASTICIZER SANKO HAIHATSU KAGAKU KENKYUSHO (JP) 1998-01-06 US disclosed
CN-1132765-A Rubber composition and vulcanizing adhesion method using the same SUMITOMO CHEMICAL CO (JP) 1996-10-09 CN disclosed