SCHEMBL4752500

SCHEMBL4752500

Cc1ccc(S(=O)(=O)NC(C)CO)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.68
ALDH1A1 P00352 5/20 0.68
CA9 Q16790 5/20 0.68
CA12 O43570 2/20 0.68
TSHR P16473 1/20 0.68
CA1 P00915 6/20 0.57
CA7 P43166 2/20 0.57
MMP2 P08253 4/20 0.56
CA14 Q9ULX7 1/20 0.56
MMP1 P03956 3/20 0.53
MMP9 P14780 3/20 0.53
MMP13 P45452 3/20 0.53
MMP8 P22894 2/20 0.53
MMP3 P08254 2/20 0.53
MMP7 P09237 2/20 0.53
CA4 P22748 2/20 0.53
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
GBA1 P04062 1/20 0.51
MMP14 P50281 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
SCHEMBL16519484 1.00 CA2 (0.68) CA2ALDH1A1CA9CA12TSHR
SCHEMBL16519485 1.00 CA2 (0.68) CA2ALDH1A1CA9CA12TSHR
SCHEMBL6324018 0.86 ADAMTS4 (0.53) CA2ALDH1A1CA9CA12TSHR
SCHEMBL6324016 0.86 ADAMTS4 (0.53) CA2ALDH1A1CA9CA12TSHR
SCHEMBL6321461 0.84 MMP2 (0.56) CA2ALDH1A1CA9CA12TSHR
SCHEMBL15801255 0.84 NR3C1 (0.51) CA2ALDH1A1CA9CA12TSHR
SCHEMBL14316552 0.84 NR3C1 (0.51) CA2ALDH1A1CA9CA12TSHR
SCHEMBL13014153 0.84 ALDH1A1 (0.49) CA2ALDH1A1CA9CA12TSHR
SCHEMBL13014370 0.84 ALDH1A1 (0.49) CA2ALDH1A1CA9CA12TSHR
SCHEMBL6321590 0.84 TDO2 (0.61) CA2ALDH1A1CA9CA12TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321016-A1 COMBINATION THERAPY FOR TREATING CANCER GONGWIN BIOPHARM CO., LTD (TW) 2023-10-12 US disclosed
US-11752160-B2 Method for reducing fat by administering benzenesulfonamide compositions GONGWIN BIOPHARM CO., LTD (TW) 2023-09-12 US disclosed
US-11752118-B2 Method for treating melanoma GONGWIN BIOPHARM CO., LTD (TW) 2023-09-12 US disclosed
CN-115160123-A Method for preparing carboxylic acid compound by oxidizing alcohol with oxygen as oxidant under catalysis of copper 复旦大学 2022-10-11 CN disclosed
CN-113402477-B Monofluoroolefin modified heteroatom cyclolactone or lactam derivative and synthetic method and application thereof 华南理工大学 2022-06-14 CN disclosed
US-20220168248-A1 METHOD FOR TREATING MELANOMA GONGWIN BIOPHARM CO., LTD (TW) 2022-06-02 US disclosed
CN-113402477-A Monofluoroolefin modified heteroatom cyclolactone or lactam derivative and synthetic method and application thereof 华南理工大学 2021-09-17 CN disclosed
US-20200338028-A1 BENZENESULFONAMIDE DERIVATIVES AND METHOD FOR MODULATING LIPID RAFT GONGWIN BIOPHARM CO., LTD. (TW) 2020-10-29 US disclosed
US-10548862-B2 Topical formulation and method for preventing or treating acne Wu, Lester J. (US) 2020-02-04 US disclosed
WO-2019208721-A1 HAIR MOISTURIZER, WHITENING AGENT, AND WHITENING COSMETIC 株式会社成和化成 (JP) 2019-10-31 WO disclosed
US-20130245011-A1 Modulators of ATP-Binding Cassette Transporters VERTEX PHARMACEUTICALS INCORPORATED 2013-09-19 US disclosed
US-8324207-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-12-04 US disclosed
US-20110306607-A1 HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-12-15 US disclosed
US-20110306607-A1 HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-12-15 US disclosed
US-7956052-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-07 US disclosed
US-20100087435-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-04-08 US disclosed
US-7659268-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-02-09 US disclosed
WO-2008145733-A2 NOVEL CHEMICAL COMPOUNDS, PRODUCTION THEREOF, AND USE THEREOF UNIVERSITÄT LEIPZIG (DE) 2008-12-04 WO disclosed
WO-2008145733-A2 NOVEL CHEMICAL COMPOUNDS, PRODUCTION THEREOF, AND USE THEREOF UNIVERSITÄT LEIPZIG (DE) 2008-12-04 WO disclosed
US-20080019915-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"); N[6-(2-hydroxymethylphenyl-1yl)-5-methylpyrimidine][(4-methoxophenyl-1-yl)cyclopopyl]-amide; genetic disorders; respiratory system disorders, cystic fibrosis, hereditary emphysema and hemochromatosis, coagulation-fibrinolysis VERTEX PHARMACEUTICALS INCORPORATED 2008-01-24 US 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 (10 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-20100087435-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 CA2 2789/4885ALDH1A1 1786/4885CA9 4024/4885
US-10548862-B2 Topical formulation and method for preventing or treating acne CUTA, STS, ALAD CA2 4374/4885ALDH1A1 669/4885CA9 2493/4885
US-11752160-B2 Method for reducing fat by administering benzenesulfonamide compositions LIPE, FABP4, LIPA CA2 4175/4885ALDH1A1 728/4885CA9 1505/4885
US-20080019915-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"); N[6-(2-hydroxymethylphenyl-1yl)-5-methylpyrimidine][(4-methoxophenyl-1-yl)cyclopopyl]-amide; genetic disorders; respiratory system disorders, cystic fibrosis, hereditary emphysema and hemochromatosis, coagulation-fibrinolysis CFTR, ABCC8, ABCB1 CA2 3603/4885ALDH1A1 3710/4885CA9 4302/4885
US-20110306607-A1 HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS KCNJ2, TRPV1, KCNJ1 CA2 226/4885ALDH1A1 1614/4885CA9 3637/4885
US-20220168248-A1 METHOD FOR TREATING MELANOMA TYR, MITF, BRAF CA2 1053/4885ALDH1A1 528/4885CA9 132/4885
US-20230321016-A1 COMBINATION THERAPY FOR TREATING CANCER TP53, MCL1, TOP2B CA2 989/4885ALDH1A1 381/4885CA9 76/4885
US-11752118-B2 Method for treating melanoma TYR, MITF, BRAF CA2 1053/4885ALDH1A1 528/4885CA9 132/4885
US-20200338028-A1 BENZENESULFONAMIDE DERIVATIVES AND METHOD FOR MODULATING LIPID RAFT ABCB4, SPTSSB, SMPD2 CA2 4026/4885ALDH1A1 1604/4885CA9 3672/4885
US-20130245011-A1 Modulators of ATP-Binding Cassette Transporters CFTR, ABCB1, ABCC2 CA2 2614/4885ALDH1A1 1991/4885CA9 3403/4885

“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.