SCHEMBL1647307

SCHEMBL1647307

COC(=O)c1cc(S(=O)(=O)Cl)ccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.59
CA1 P00915 4/20 0.59
CA9 Q16790 4/20 0.59
CA12 O43570 3/20 0.59
CA7 P43166 3/20 0.59
CA14 Q9ULX7 3/20 0.59
PTGS2 P35354 2/20 0.53
GAA P10253 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
PTGS1 P23219 1/20 0.51
TSHR P16473 2/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 3/20 0.47
PDK2 Q15119 1/20 0.46
PDK4 Q16654 1/20 0.46
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 1/20 0.44
EGFR P00533 3/20 0.43

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
SCHEMBL28205156 0.94 CA2 (0.53) CA2CA1CA9CA12CA7
SCHEMBL29541454 0.86 ALDH1A1 (0.49) CA2CA1CA9CA12CA7
SCHEMBL17363910 0.85 HSD17B10 (0.62) CA2CA1CA9CA12CA7
SCHEMBL2642603 0.85 CA2 (0.61) CA2CA1CA9CA12CA7
SCHEMBL4419601 0.85 PTGS2 (0.63) CA2CA1CA9CA12CA7
SCHEMBL11745347 0.84 PTGS2 (0.56) CA2CA1CA9CA12CA7
SCHEMBL11745342 0.84 PTGS2 (0.56) CA2CA1CA9CA12CA7
SCHEMBL4904491 0.83 ALDH1A1 (0.47) CA2GAAMEN1KMT2ATSHR
SCHEMBL27319746 0.83 CA2 (0.59) CA2CA1CA9CA12CA7
SCHEMBL18547926 0.83 ALDH1A1 (0.65) CA2GAAMEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105777669-B The method that 2 ethyoxyl 5 (the base sulfonyl of 4 methyl piperazine 1) benzoic acid are prepared with gaultherolin 锦州医科大学 2018-03-20 CN claimed
CN-105777669-A Method for preparing 2-ethyoxyl-5-(4-methyl piperazine-1-sulfonyl) benzoic acid from methyl salicylate 锦州医科大学 2016-07-20 CN claimed
CN-117800904-A ROR gamma inhibitors containing sulfonyl structures 正大天晴药业集团股份有限公司 2024-04-02 CN disclosed
WO-2024028169-A1 NOVEL SPECIFICALLY SUBSTITUTED THIOPHENOLIC COMPOUNDS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2024-02-08 WO disclosed
US-20240010641-A1 N-Linked Glycosylation Inhibitors and Methods of Using Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-01-11 US disclosed
CN-113166061-B ROR gamma inhibitors containing sulfonyl structures 正大天晴药业集团股份有限公司 2023-11-21 CN disclosed
CN-110511173-B Indole alkyl piperazine benzamide compound and application thereof 复旦大学 2023-06-23 CN disclosed
US-11396503-B2 Sulfonyl substituted bicyclic compound which acts as ROR inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-07-26 US disclosed
CN-111094267-B Sulfonyl-substituted bicyclic compounds as ROR gamma inhibitors 正大天晴药业集团股份有限公司 2022-06-14 CN disclosed
WO-2022051286-A1 N-LINKED GLYCOSYLATION INHIBITORS AND METHODS OF USING SAME YALE UNIVERSITY (US) 2022-03-10 WO disclosed
US-11219625-B2 Inhibitors of N-linked glycosylation and methods using same YALE UNIVERSITY (US) 2022-01-11 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
CN-100396677-C 2-thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2008-06-25 CN disclosed
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE-GMBH (DE) 2006-10-19 US disclosed
WO-2005110981-A1 AMINOALCOHOL DERIVATIVES ASTELLAS PHARMA INC. (JP) 2005-11-24 WO disclosed
CN-1675197-A 2-thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2005-09-28 CN disclosed
US-20050130983-A1 Pyrrolopyrimidinone derivatives, process for preparation thereof, and method of using and composition comprising them IN2GEN CO., LTD. (KR) 2005-06-16 US disclosed
US-20040106653-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-03 US disclosed
WO-2004045610-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2004-06-03 WO disclosed
EP-1362858-A1 Pyrrolopyrimidinone derivates, process of preparation and use SK Chemicals Co., Ltd. (KR) 2003-11-19 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 (6 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-20240010641-A1 N-Linked Glycosylation Inhibitors and Methods of Using Same ENGASE, UGGT1, GALNT1 CA2 3676/4885CA1 2832/4885CA9 1394/4885
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics IL2, TPMT, IFNG CA2 1113/4885CA1 3585/4885CA9 3579/4885
US-11219625-B2 Inhibitors of N-linked glycosylation and methods using same ENGASE, FUT5, B3GNT2 CA2 3839/4885CA1 2582/4885CA9 1949/4885
US-20050130983-A1 Pyrrolopyrimidinone derivatives, process for preparation thereof, and method of using and composition comprising them DHPS, SDHA, FDPS CA2 4395/4885CA1 4438/4885CA9 3146/4885
US-11396503-B2 Sulfonyl substituted bicyclic compound which acts as ROR inhibitor RORC, RORA, RORB CA2 2877/4885CA1 2135/4885CA9 2273/4885
US-20040106653-A1 Aminoalcohol derivatives FANCD2, FANCI, HRH2 CA2 696/4885CA1 2450/4885CA9 1808/4885

“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.