SCHEMBL34748

SCHEMBL34748

CS(=O)(=O)c1ccccc1C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.62
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
MMP1 P03956 1/20 0.60
MMP2 P08253 1/20 0.60
MMP9 P14780 1/20 0.60
MMP8 P22894 1/20 0.60
MMP13 P45452 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.56
F2 P00734 3/20 0.55
PRSS1 P07477 3/20 0.55
PRSS2 P07478 3/20 0.55
PRSS3 P35030 3/20 0.55
CA12 O43570 6/20 0.54
CA9 Q16790 6/20 0.54
ALOX15 P16050 2/20 0.54
ALDH1A1 P00352 2/20 0.54
FABP4 P15090 2/20 0.51
FABP3 P05413 1/20 0.51

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
SCHEMBL29838630 1.00 BCAT2 (0.62) BCAT2CA1CA2MMP1MMP2
Hydrochloric Acid SCHEMBL7869876 0.98 BCAT2 (0.61) BCAT2CA1CA2MMP1MMP2
Formaldehyde SCHEMBL5182372 0.96 BCAT2 (0.59) BCAT2CA1CA2MMP1MMP2
SCHEMBL4321077 0.84 BCAT2 (0.59) BCAT2CA1CA2MMP1MMP2
SCHEMBL12492308 0.83 ALOX15 (0.67) BCAT2CA1CA2MMP1MMP2
SCHEMBL6631818 0.83 BCAT2 (0.62) BCAT2CA1CA2MMP1MMP2
SCHEMBL30455577 0.83 BCAT2 (0.62) BCAT2CA1CA2MMP1MMP2
SCHEMBL28208230 0.83 BCAT2 (0.58) BCAT2CA1CA2MMP1MMP2
SCHEMBL11348903 0.82 CA1 (0.64) CA1CA2MMP1MMP2MMP9
SCHEMBL30444901 0.82 CA1 (0.64) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-221460047-U Waste liquid treatment device for methanesulfonyl benzoic acid production 河北冀泽生物科技有限公司 2024-08-02 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-111886020-B Peptide macrocycles against acinetobacter baumannii 豪夫迈·罗氏有限公司 2024-04-05 CN claimed
EP-4065577-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES Bayer Aktiengesellschaft (DE) 2022-10-05 EP claimed
WO-2021105091-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-03 WO claimed
EP-3551633-B1 SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2021-03-31 EP claimed
CN-110520410-A The synthetic method of mesotrione GHARDA CHEMICALS LTD 2019-11-29 CN claimed
EP-3551634-A1 SUBSTITUTED PYRAZOLOAZEPIN-8-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2019-10-16 EP claimed
EP-3551633-A1 SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2019-10-16 EP claimed
WO-2018108230-A1 SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2018-06-21 WO claimed
US-7781592-B2 Thione derivative, method for the preparation thereof, and pharmaceutical composition containing the same CJ CHEILJEDANG CORPORATION (KR) 2010-08-24 US claimed
US-20080161325-A1 e.g. N1-[3-amino-4-(3,5-difluorophenyl)-2-hydroxybutyl]-3-(butylsulfonyl)-N1-(3-ethylbenzyl)-D-alaninamide dihydrochloride; inhibitors of amyloid beta-secretase enzyme; neurodegenerative diseases: Alzheimer's, Parkinson's diseases, Down's syndrome ELAN PHARMACEUTICALS, INC. 2008-07-03 US claimed
US-20080090875-A1 Thione Derivative, Method For The Preparation Thereof, And Pharmaceutical Composition Containing The Same CJC CORPORATION (KR) 2008-04-17 US claimed
WO-2007048064-A2 AMINO-PYRIMIDINES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS, INC. (US) 2007-04-26 WO claimed
WO-2005051941-A1 THIONE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME CJ CORPORATION (KR) 2005-06-09 WO claimed
CN-1127482-C Sulfuryl diphenyl indole compound and preparation process and use in medicine INST OF MEDICINE CHINESE ACADE (CN) 2003-11-12 CN claimed
CN-1038584-C Preparation of methylsulfonylbenzoic acids BASF AG (DE) 1998-06-03 CN 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
CN-1090843-A The preparation method of methyl sulfonylbenzoic acid BASF AG (DE) 1994-08-17 CN 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 (2 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-20080090875-A1 Thione Derivative, Method For The Preparation Thereof, And Pharmaceutical Composition Containing The Same TPMT, TST, CYP3A5 BCAT2 3661/4885CA1 1852/4885CA2 1649/4885
US-20080161325-A1 e.g. N1-[3-amino-4-(3,5-difluorophenyl)-2-hydroxybutyl]-3-(butylsulfonyl)-N1-(3-ethylbenzyl)-D-alaninamide dihydrochloride; inhibitors of amyloid beta-secretase enzyme; neurodegenerative diseases: Alzheimer's, Parkinson's diseases, Down's syndrome BACE1, APP, BACE2 BCAT2 211/4885CA1 1011/4885CA2 2723/4885

“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.