SCHEMBL12307

SCHEMBL12307

Cc1ccccc1S(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
TSHR P16473 1/20 0.45
ACHE P22303 1/20 0.45
RAPGEF4 Q8WZA2 1/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BCAT2 O15382 1/20 0.41
HSD11B1 P28845 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
EDNRA P25101 1/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40

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
SCHEMBL28278788 1.00 L3MBTL1 (0.50) L3MBTL1TSHRACHERAPGEF4ALDH1A1
Bromide SCHEMBL28167960 0.97 L3MBTL1 (0.48) L3MBTL1TSHRACHERAPGEF4ALDH1A1
Cyanide SCHEMBL27700014 0.93 L3MBTL1 (0.45) L3MBTL1TSHRACHERAPGEF4ALDH1A1
Chloroform SCHEMBL28290992 0.91 L3MBTL1 (0.44) L3MBTL1TSHRACHERAPGEF4ALDH1A1
Carbon Tetrachloride SCHEMBL28292390 0.91 L3MBTL1 (0.44) L3MBTL1TSHRACHERAPGEF4ALDH1A1
SCHEMBL8106699 0.83 LOX (0.47) L3MBTL1ALDH1A1KDM4ETP53BCAT2
SCHEMBL17922579 0.81 HSD11B1 (0.47) L3MBTL1TSHRACHEALDH1A1KDM4E
SCHEMBL29468592 0.81 ALDH1A1 (0.55) L3MBTL1TSHRACHERAPGEF4ALDH1A1
SCHEMBL4533183 0.81 TSHR (0.47) L3MBTL1TSHRACHERAPGEF4ALDH1A1
SCHEMBL475089 0.81 ALDH1A1 (0.55) L3MBTL1TSHRACHERAPGEF4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111499063-A Comprehensive recycling treatment system and method for p-methylsulfonyl toluene wastewater 利民化学有限责任公司 2020-08-07 CN claimed
CN-107501141-B A kind of preparation method of pair of methylsulfonyltoluene 山东国邦药业有限公司 2019-11-05 CN claimed
CN-110305047-A A kind of method that continuous flow prepares 2- nitro -4- methylsulfonyltoluene 海利贵溪化工农药有限公司 2019-10-08 CN claimed
CN-110265670-A A kind of method of Subjective and Objective strategy synthetic nitrogen, the double-doped carbon-based dual purpose catalyst of other hetero atoms 北京化工大学 2019-09-20 CN claimed
CN-110256308-A Synthesis process of mesotrione 湖北广富林生物制剂有限公司 2019-09-20 CN claimed
CN-110229088-A Preparation method of mesotrione intermediate 湖北广富林生物制剂有限公司 2019-09-13 CN claimed
CN-110078646-A A kind of production method of pair of methylsulfonyltoluene 浙江嘉化新材料有限公司 2019-08-02 CN claimed
CN-106957250-B A kind of bromination process of pair of methylsulfonyltoluene 湖北君尚科技有限公司 2019-04-09 CN claimed
CN-106883155-B A kind of synthetic method of pair of methyl sulfone benzaldehyde 江西天戌药业有限公司 2019-04-05 CN claimed
CN-109503437-A The preparation method of 2- nitryl-4-thiamphenicol benzoic acid 江苏新鑫隆医药科技股份有限公司 2019-03-22 CN claimed
CN-102924346-A Method for synthesizing methyl sulfone base dibromo toluene SHANDONG RUNKE CHEMICAL CO LTD 2013-02-13 CN claimed
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US claimed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US claimed
EP-2200440-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS Crestone, Inc. (US) 2010-06-30 EP claimed
EP-1718605-B1 PROCESSES FOR THE PREPARATION OF ARYL-AND HETEROARYL-ALKYLSULFONYL HALIDES WYETH CORP (US) 2009-06-17 EP claimed
US-20090117406-A1 CONCENTRATE FOR FILM PRESERVATION ISP INVESTMENTS INC. 2009-05-07 US claimed
WO-2009015208-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 WO claimed
EP-0594027-B1 Method for the preparation of methylsulphonylbenzoic acids BASF AG (DE) 1996-08-21 EP claimed
US-5424481-A Preparation of methylsulfonylbenzoic acids BASF AKTIENGESELLSCHAFT (DE) 1995-06-13 US claimed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA L3MBTL1 4619/4885TSHR 2748/4885ACHE 729/4885

“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.