Toluene

Toluene

SCHEMBL434901

Cc1ccccc1.c1ccncc1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.65
TSHR P16473 2/20 0.65
LMNA P02545 1/20 0.65
ALOX12 P18054 1/20 0.65
TDP1 Q9NUW8 3/20 0.53
NAPRT Q6XQN6 1/20 0.53
NOTUM Q6P988 1/20 0.46
HPGD P15428 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 2/20 0.37
CES2 O00748 1/20 0.37

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
SCHEMBL19443810 0.97 TSHR (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27304983 0.97 ACHE (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27614086 0.97 ACHE (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27623492 0.97 ACHE (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27945578 0.97 ACHE (0.61) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27680499 0.97 ACHE (0.61) ACHETSHRLMNAALOX12TDP1
SCHEMBL21183486 0.97 ACHE (0.59) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL27617227 0.92 TSHR (0.55) ACHETSHRLMNAALOX12TDP1
Toluene SCHEMBL28219498 0.91 ACHE (0.69) ACHETSHRLMNAALOX12TDP1
P-Xylene SCHEMBL1700858 0.91 TDP1 (0.56) 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 246 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850199-A Preparation method of high-purity sulfisoxazole sodium 天和药业股份有限公司 2023-03-28 CN claimed
CN-213769907-U Pyridine toluene storage tank for producing sulfadimethoxine 安达辉煌生物医药科技有限公司 2021-07-23 CN claimed
CN-109206454-A One kind is based on the tetra- serobila selective probe of G- of double-core iridium (III) complex 青岛农业大学 2019-01-15 CN claimed
CN-108752614-A A kind of blending proton exchange membrane and preparation method thereof containing compatilizer 四川大学 2018-11-06 CN claimed
CN-107623138-A A kind of compound proton exchange membrane and preparation method thereof 四川大学 2018-01-23 CN claimed
EP-3212597-A1 IMPROVED FLUORINATION PROCESS Sandoz AG (CH) 2017-09-06 EP claimed
CN-107074899-A Improved flaorination process 桑多斯股份公司 2017-08-18 CN claimed
WO-2016066283-A1 IMPROVED FLUORINATION PROCESS SANDOZ AG (CH) 2016-05-06 WO claimed
CN-103263872-A Dispersing agent, color pigment liquid and photoresist BOE TECHNOLOGY GROUP CO LTD 2013-08-28 CN claimed
EP-1483272-B1 UREA OR CARBAMATE DERIVATIVES OF CROWN ETHERS AND SILICON USEFUL FOR THE PREPARATION OF SUPPORTS FOR CHROMATOGRAPHIC SEPARATION OF METAL CATIONS AND ORGANIC MOLECULES COMPRISING AN AMINO FUNCTION COMMISSARIAT ENERGIE ATOMIQUE (FR) 2006-01-11 EP claimed
EP-1483272-A1 UREA OR CARBAMATE DERIVATIVES OF CROWN ETHERS AND SILICON USEFUL FOR THE PREPARATION OF SUPPORTS FOR CHROMATOGRAPHIC SEPARATION OF METAL CATIONS AND ORGANIC MOLECULES COMPRISING AN AMINO FUNCTION Commissariat à l'Energie Atomique (FR) 2004-12-08 EP claimed
WO-2003062250-A1 UREA OR CARBAMATE DERIVATIVES OF CROWN ETHERS AND SILICON USEFUL FOR THE PREPARATION OF SUPPORTS FOR CHROMATOGRAPHIC SEPARATION OF METAL CATIONS AND ORGANIC MOLECULES COMPRISING AN AMINO FUNCTION COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2003-07-31 WO claimed
CN-1025917-C Synthetic method of metronidazole benzoate HEBEI PHARMACEUTICAL FACTORY T (CN) 1994-09-14 CN claimed
CN-113423802-B Polymerizable compounds and their use in liquid crystal displays 默克专利股份有限公司 2024-05-28 CN disclosed
CN-115850199-B Preparation method of high-purity sodium sulfaisoxazole 天和药业有限公司 2024-05-03 CN disclosed
CN-115850199-B Preparation method of high-purity sodium sulfaisoxazole 天和药业有限公司 2024-05-03 CN disclosed
US-4089900-A 4-DEDIMETHYLAMINOTETRACYCLINES PFIZER INC. (US) 1978-05-16 US disclosed
US-4066694-A ANTIBIOTICS PFIZER INC. (US) 1978-01-03 US disclosed
US-3995059-A CHOLESTEROL LOWERING AGENTS SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-11-30 US disclosed
US-3980661-A Hydrolysis of nitriles NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1976-09-14 US disclosed