Toluene

Toluene

SCHEMBL1826322

Cc1ccccc1.O=S(O)O

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.65
LMNA P02545 3/20 0.65
TSHR P16473 1/20 0.65
ALOX12 P18054 1/20 0.65
CES2 O00748 2/20 0.48
CES1 P23141 2/20 0.48
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.40
AKR1C3 P42330 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
PTGS2 P35354 1/20 0.38
CYP1B1 Q16678 1/20 0.38
VCP P55072 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
Toluene SCHEMBL28496210 0.97 LMNA (0.61) ACHELMNATSHRALOX12CES2
Toluene SCHEMBL2638449 0.88 ACHE (0.73) ACHELMNATSHRALOX12CES2
Toluene SCHEMBL27483938 0.87 LMNA (0.55) ACHELMNATSHRALOX12CES2
Toluene SCHEMBL28106985 0.85 LMNA (0.52) ACHELMNATSHRALOX12CES2
P-Xylene SCHEMBL28670186 0.84 ACHE (0.57) ACHELMNATSHRCES2CES1
Toluene SCHEMBL15844372 0.84
Toluene SCHEMBL9622812 0.84
Toluene SCHEMBL27883778 0.84 ACHE (0.92) ACHELMNATSHRALOX12CES2
Toluene SCHEMBL28819334 0.83 TSHR (0.50) ACHELMNATSHRALOX12CES2
Toluene SCHEMBL4528819 0.82 ACHE (0.65) ACHELMNATSHRALOX12CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115369431-A Synthetic method of S- (p-tolyl) 4-methylbenzene sulfite 湖北中烟工业有限责任公司 2022-11-22 CN claimed
CN-111170941-A Preparation method of 1-cyclopropyl-6, 7-difluoro-8-methoxy fluoroquinolone-3-carboxylic ester 江西农业大学 2020-05-19 CN claimed
CN-101858152-B Strengthening construction method for through cracking concrete crossbeam ZHU HONG 2011-09-28 CN claimed
CN-101858152-A Strengthening construction method for through cracking concrete crossbeam ZHU HONG 2010-10-13 CN claimed
EP-0687951-B1 Granular or tablet-form color-developing composition KONISHIROKU PHOTO IND (JP) 2001-10-10 EP claimed
US-11929257-B2 Etching solution and method for aluminum nitride VERSUM MATERIALS US, LLC (US) 2024-03-12 US disclosed
CN-111170941-B Preparation method of 1-cyclopropyl-6, 7-difluoro-8-methoxy fluoroquinolone-3-carboxylic acid ester 江西农业大学 2023-07-25 CN disclosed
CN-115369431-A Synthetic method of S- (p-tolyl) 4-methylbenzene sulfite 湖北中烟工业有限责任公司 2022-11-22 CN disclosed
CN-115369431-A Synthetic method of S- (p-tolyl) 4-methylbenzene sulfite 湖北中烟工业有限责任公司 2022-11-22 CN disclosed
CN-115369431-A Synthetic method of S- (p-tolyl) 4-methylbenzene sulfite 湖北中烟工业有限责任公司 2022-11-22 CN disclosed
US-20220367199-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE VERSUM MATERIALS US, LLC (US) 2022-11-17 US disclosed
EP-3959291-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE Versum Materials US, LLC (US) 2022-03-02 EP disclosed
WO-2007110538-A2 DYEING COMPOSITION CONTAINING A MASKED THIOL FLUORESCENT COLORANT COMPRISING A DIMETHYLAMINO GROUP, WITH AN INTERNAL CATIONIC CHARGE, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING SAID COLORANT AND DISULPHIDE COLORANTS L'ORÉAL (FR) 2007-10-04 WO disclosed
WO-2007110534-A2 DYEING COMPOSITION COMPRISING A THIOL/DISULPHIDE FLUORESCENT COLORANT HAVING AN EXTERNAL CATIONIC CHARGE, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING SAID COLORANT L'ORÉAL (FR) 2007-10-04 WO disclosed
WO-2007110531-A2 DYEING COMPOSITION CONTAINING A THIOL/DISULPHIDE NAPHTHYLIMIDE FLUORESCENT COLORANT, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING SAID COLORANT L'ORÉAL (FR) 2007-10-04 WO disclosed
WO-2007110535-A2 DYEING COMPOSITION CONTAINING A THIOL/DISULPHIDE FLUORESCENT COLORANT COMPRISING AN ORTHO-PYRIDINIUM GROUP WITH AN INTERRUPTED ALKYLENE CHAIN AND AN EXTERNAL CATIONIC LOAD, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING SAID COLORANT L'ORÉAL (FR) 2007-10-04 WO disclosed
WO-2007110542-A2 METHOD OF DYEING AND LIGHTENING KERATIN MATERIALS IN THE PRESENCE OF A REDUCING AGENT COMPRISING A FLUORESCENT DISULPHIDE DYE L'OREAL (FR) 2007-10-04 WO disclosed
EP-0687951-B1 Granular or tablet-form color-developing composition KONISHIROKU PHOTO IND (JP) 2001-10-10 EP disclosed
CN-1132216-A Copolycarbonate, copolycarbonate composition, and method for their manufacture GEN ELECTRIC (US) 1996-10-02 CN disclosed
CN-1130648-A Copolycarbonate, copolycarbonate composition, and method for their manufacture GEN ELECTRIC (US) 1996-09-11 CN disclosed