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 SCHEMBL8431863 0.88 TAAR1 (0.50) LMNATSHRTAAR1ADRA2AADRA2C
Isopropylbenzene SCHEMBL11254813 0.88 — —
Isopropylbenzene SCHEMBL6568 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
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