SCHEMBL4158892

SCHEMBL4158892

Cc1cccc(C)c1S(C)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 7/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
KDM4E B2RXH2 3/20 0.38
GAA P10253 3/20 0.38
AHR P35869 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 2/20 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
SCHEMBL17689094 0.84 ACHE (0.46) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL13131553 0.84 SLC40A1 (0.44) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL23507187 0.84 TRPA1 (0.48) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL5638259 0.84 CD44 (0.48) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL30450974 0.82 ALDH1A1 (0.56) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL1200695 0.82 ALDH1A1 (0.56) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL31311046 0.80 CA2 (0.42) MAPK1ALDH1A1CA1CA2CA7
SCHEMBL2052455 0.80 KMT2A (0.45) KEAP1NFE2L2MEN1KMT2ACYP1A2
SCHEMBL647766 0.79 KEAP1 (0.35) KEAP1NFE2L2MEN1HPGDKMT2A
SCHEMBL15461578 0.79 TSHR (0.52) KEAP1NFE2L2MEN1HPGDKMT2A

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111170908-B Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2021-08-17 CN claimed
CN-111170908-A Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2020-05-19 CN claimed
EP-1718605-B1 PROCESSES FOR THE PREPARATION OF ARYL-AND HETEROARYL-ALKYLSULFONYL HALIDES WYETH CORP (US) 2009-06-17 EP claimed
CN-111170908-B Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2021-08-17 CN disclosed
CN-111170908-B Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2021-08-17 CN disclosed
CN-111170908-A Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2020-05-19 CN disclosed
CN-111170908-A Synthesis method of 2, 4-dimethyl-3-methylsulfonyl halogeno-benzene 北京印刷学院 2020-05-19 CN disclosed
US-20140038822-A1 USE OF SUBSTITUTED SPIROCYCLIC SULFONAMIDOCARBOXYLIC ACIDS, CARBOXYLIC ESTERS THEREOF, CARBOXAMIDES THEREOF AND CARBONITRILES THEREOF OR SALTS THEREOF FOR ENHANCEMENT OF STRESS TOLERANCE IN PLANTS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-06 US disclosed
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-20090163692-A1 AROMATIC POLYETHERS GENERAL ELECTRIC COMPANY (US) 2009-06-25 US disclosed
US-20080318966-A1 Sinomenine Derivatives and Preparation and Uses Thereof NIMBUS INNOWORKS LIMITED (CN) 2008-12-25 US disclosed
US-7405030-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2008-07-29 US disclosed
EP-1930339-A2 Imide compound MITSUI CHEMICALS, INC. (JP) 2008-06-11 EP disclosed
US-20070259151-A1 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-11-08 US disclosed
US-7259260-B2 Imide compound and optical recording media made by using the same MITSUI CHEMICALS, INC. (JP) 2007-08-21 US disclosed
WO-2007070703-A2 SINOMENINE DERIVATIVES AND PREPARATION AND USES THEREOF NATUREMED GROUP CORPORATION (US) 2007-06-21 WO disclosed
US-20070054084-A1 Optical recording medium and compound used for the same MITSUI CHEMICALS, INC. (JP) 2007-03-08 US disclosed
EP-1672626-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED IN THE OPTICAL RECORDING MEDIUM Mitsui Chemicals, Inc. (JP) 2006-06-21 EP disclosed
US-20050208425-A1 Imide compound and optical recording media made by using the same YAMAMOTO CHEMICALS, INC. (JP) 2005-09-22 US disclosed
EP-1445115-A1 IMIDE COMPOUNDS AND OPTICAL RECORDING MEDIA MADE BY USING THE SAME Mitsui Chemicals, Inc. (JP) 2004-08-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 KEAP1 3863/4885NFE2L2 2216/4885MEN1 979/4885
US-20080318966-A1 Sinomenine Derivatives and Preparation and Uses Thereof OPRM1, SIN3A, MIF KEAP1 537/4885NFE2L2 452/4885MEN1 2924/4885
US-20050208425-A1 Imide compound and optical recording media made by using the same CRY1, MTNR1A, TRPA1 KEAP1 3821/4885NFE2L2 523/4885MEN1 18/4885
US-20140038822-A1 USE OF SUBSTITUTED SPIROCYCLIC SULFONAMIDOCARBOXYLIC ACIDS, CARBOXYLIC ESTERS THEREOF, CARBOXAMIDES THEREOF AND CARBONITRILES THEREOF OR SALTS THEREOF FOR ENHANCEMENT OF STRESS TOLERANCE IN PLANTS STS, SCLY, TST KEAP1 326/4885NFE2L2 793/4885MEN1 4322/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.