Toluene

Toluene

SCHEMBL409208

Cc1ccccc1.OCCO

nearest known ligand 0.69

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.69
TSHR P16473 2/20 0.69
LMNA P02545 2/20 0.69
ALOX12 P18054 1/20 0.69
TDP1 Q9NUW8 2/20 0.46
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
HPGD P15428 1/20 0.42
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PABPC1 P11940 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 SCHEMBL11669463 0.88 TSHR (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL11300497 0.88 LMNA (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL906170 0.88 LMNA (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL5199381 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27342895 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL11136681 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL5198578 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL28769535 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL22729215 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL6443613 0.88 ACHE (0.69) ACHETSHRLMNAALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114249789-A Preparation method of 7 alpha-methyl-3, 3-dimethoxy-5 (10) -androstene-17-one 湖南普尔生物医药有限公司 2022-03-29 CN claimed
CN-111825722-A Saturated red luminescent fluorenyl benzoquinoline iridium complex 北京印刷学院 2020-10-27 CN claimed
CN-105906477-B A kind of method of continuous azeotropy distillation separation of methylbenzene-ethylene glycol mixture 济南大学 2018-11-23 CN claimed
CN-104788499-B Two fluorenes trifluoromethyl pyridine complex of iridium of spiral shell and its preparation method and application 北京印刷学院 2018-04-13 CN claimed
CN-105906477-A Method for separating toluene-ethylene glycol mixture by continuous azeotropic distillation 济南大学 2016-08-31 CN claimed
CN-104788499-A Spirobifluorene trifluoromethyl pyridine iridium complex as well as preparation method and application thereof BEIJING INST GRAPHIC COMM 2015-07-22 CN claimed
CN-104402871-A Method for specifically preparing derivative of 2-(1H-1, 2, 4-triazole-1-methyl)-1, 3-dioxolane JIANGSU FREY AGROCHEMICALS CO LTD 2015-03-11 CN claimed
EP-2117476-B1 TUBULAR SUPPORTING PROSTHESIS HAVING A HEART VALVE, PARTICULARLY FOR AORTIC VALVE REPLACEMENT UNIV ZUERICH (CH) 2014-01-22 EP claimed
CN-101045552-A Surface chemical preparation method of cadmium sulfide semiconductor nanoparticle UNIV SHENYANG TECHNOLOGY (CN) 2007-10-03 CN claimed
CN-111825722-B Saturated red-light-emitting fluorenyl benzoquinoline iridium complex 北京印刷学院 2023-06-09 CN disclosed
CN-114249789-B Preparation method of 7 alpha-methyl-3, 3-dimethoxy-5 (10) -androstene-17-one 湖南普尔生物医药有限公司 2023-06-02 CN disclosed
CN-111233704-B Method for preparing 6-aminocapronitrile product 湖北三宁碳磷基新材料产业技术研究院有限公司 2023-01-06 CN disclosed
CN-114249789-A Preparation method of 7 alpha-methyl-3, 3-dimethoxy-5 (10) -androstene-17-one 湖南普尔生物医药有限公司 2022-03-29 CN disclosed
CN-110964365-B Preparation method of nano-silver-loaded graphene and graphene PTC slurry 广东南海启明光大科技有限公司 2021-08-24 CN disclosed
CN-85102721-A Produce the method for aklylene glycol with the organo-metallic salt anionic 1986-10-15 CN disclosed
EP-0125454-A1 A process for reducing the hydrolyzable chloride content of an epoxidation product THE DOW CHEMICAL COMPANY (US) 1984-11-21 EP disclosed
EP-0107969-A2 Co-reactive urethane surfactants and stable aqueous epoxy dispersions INTEREZ, Inc. (a Georgia corporation) (US) 1984-05-09 EP disclosed
US-4423201-A POLYETHERURETHANE SURFACTANT MADE FROM POLYOXYKYLENE GLYCOL, DIISOCYANATE, AND DIHYDROXYPHENOL CELANESE CORPORATION (US) 1983-12-27 US disclosed
US-4276126-A AZEOTROPIC DISTILLATION, HYDROCARBONS NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1981-06-30 US disclosed
US-4273784-A PROSTAGLANDINS WITH CYCLOPROPANE RING IN 2,3 POSITION, OXYTOCICS, ANTISECRETORY, ANTICOAGULANTS, DECONGESTANTS SANDOZ LTD. (CH) 1981-06-16 US disclosed