SCHEMBL31313

SCHEMBL31313

Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.62

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.62
LMNA P02545 2/20 0.59
ALDH1A1 P00352 5/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
TSHR P16473 2/20 0.56
CA12 O43570 1/20 0.56
CA3 P07451 1/20 0.56
CA6 P23280 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
NT5E P21589 1/20 0.56

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
SCHEMBL29991938 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL34 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL5068661 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
P-Xylene SCHEMBL8660591 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL11432043 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL1705904 1.00 GAA (0.62) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL1594407 0.97 GAA (0.59) GAALMNAALDH1A1SMN1; SMN2TDP1
Water SCHEMBL214962 0.97 GAA (0.59) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL1345322 0.97 GAA (0.59) GAALMNAALDH1A1SMN1; SMN2TDP1
SCHEMBL22802539 0.97 GAA (0.59) GAALMNAALDH1A1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720073-A1 SOLID FORMS OF A MACROCYCLIC FARNESYLTRANSFERASE INHIBITOR AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE MACROCYCLIC COMPOUND AND ITS SOLID FORMS Kura Oncology, Inc. (US) 2026-04-08 EP claimed
WO-2025111563-A1 MILK PEPTIDE COMPOSITIONS FOR PHARMACEUTICAL AND COSMECEUTICAL USE MATRUBIALS INC. (US) 2025-05-30 WO claimed
WO-2024245364-A1 SOLID FORMS OF A MACROCYCLIC FARNESYLTRANSFERASE INHIBITOR AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE MACROCYCLIC COMPOUND AND ITS SOLID FORMS KURA ONCOLOGY, INC. (US) 2024-12-05 WO claimed
CN-115197116-A Preparation method of N-phenylmaleimide 中国石油化工股份有限公司 2022-10-18 CN claimed
US-20120046471-A1 PROCESS FOR PREPARING ORGANIC COMPOUNDS BY A TRANSITION METAL-CATALYSED CROSS-COUPLING REACTION OF AN ARYL-X, HETEROARYL-X, CYCLOALKENYL-X OR ALKENYL-X COMPOUND WITH AN ALKYL, ALKENYL, CYCLOALKYL OR CYCLOALKENYL HALIDE SALTIGO GMBH (DE) 2012-02-23 US claimed
US-20120029044-A1 7-AZONIABICYCLO[2.2.1]HEPTANE DERIVATIVES, METHODS OF PRODUCTION, AND PHARMACEUTICAL USES THEREOF THERON PHARMACEUTICALS INC. 2012-02-02 US claimed
US-8030520-B2 Process for preparing organic compounds by a transition metal-catalysed cross-coupling reaction of an aryl-X, heteroaryl-X, cycloalkenyl-X or alkenyl-X compound with an alkyl, alkenyl, cycloalkyl or cycloalkenyl halide SALTIGO GMBH (DE) 2011-10-04 US claimed
EP-2107047-B1 Method for producing organic compounds by means of a transition metal-catalysed cross-coupling reaction of an aryl-X, heteroaryl-X, cycloalkenyl-X or alkenyl-X compound with an alkyl, alkenyl, cycloalkyl or cycloalkenyl halogenide SALTIGO GMBH (DE) 2011-09-28 EP claimed
US-20110220844-A1 SULFONATE MODIFIED NANOCRYSTALS Life Technologies Corporation 2011-09-15 US claimed
JP-2011524897-A 2011-09-08 JP claimed
US-8003617-B2 e.g. 1-(3',4'-ethylenedioxy)phenyl-2-nonanoylamino-3-pyrrolidino-1-propanol; glucosylceramide synthase inhibitor; inhibits glycosphingolipid synthesis; antidiabetic, hypoglycemic agent; non-insulin dependent diabetes, obesity, Gaucher's disease GENZYME CORPORATION (US) 2011-08-23 US claimed
WO-2011094434-A2 7-AZONIABICYCLO [2.2.1] HEPTANE DERIVATIVES, METHODS OF PRODUCTION, AND PHARMACEUTICAL USES THEREOF THERON PHARMACEUTICALS, INC. (US) 2011-08-04 WO claimed
EP-2342161-A2 SULFONATE MODIFIED NANOCRYSTALS Life Technologies Corporation (US) 2011-07-13 EP claimed
WO-2011073662-A1 COMBINATION OF A BENZOXAZINONE AND A FURTHER AGENT FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2011-06-23 WO claimed
EP-2303266-A1 PHARMACEUTICAL COMPOSITION COMPRISING A 4-HYDROXY-2-OXO-2, 3- DIHYDRO-1, 3-BENZOTHIAZOL-7-YL COMPOUND FOR MODULATION OF BETA2-ADRENORECEPTOR ACTIVITY AstraZeneca AB (SE) 2011-04-06 EP claimed
US-20110053987-A1 PYRIDINIUM AND THIAZOLIUM CONJUGATES INCLUDING POLYETHYLENE GLYCOLS AND METHODS OF USING THE SAME MYCOSOL, INC. 2011-03-03 US claimed
EP-1117659-B1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS WYETH CORP (US) 2003-12-03 EP claimed
EP-4705244-A1 AN EFFICIENT SEPARATION PROCESS FOR RARE EARTH ELEMENT COMPOUNDS AND NOVEL RARE EARTH ELEMENT COMPLEXES USED THEREFOR ETH Zürich (CH) 2026-03-11 EP disclosed
EP-0213925-A2 Copolymerizable UV stabilizers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-03-11 EP disclosed
US-4198424-A ANALGESICS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1980-04-15 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 (3 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-20110053987-A1 PYRIDINIUM AND THIAZOLIUM CONJUGATES INCLUDING POLYETHYLENE GLYCOLS AND METHODS OF USING THE SAME PLPBP, PTPMT1, PNPO GAA 1009/4885LMNA 4609/4885ALDH1A1 3076/4885
US-20120046471-A1 PROCESS FOR PREPARING ORGANIC COMPOUNDS BY A TRANSITION METAL-CATALYSED CROSS-COUPLING REACTION OF AN ARYL-X, HETEROARYL-X, CYCLOALKENYL-X OR ALKENYL-X COMPOUND WITH AN ALKYL, ALKENYL, CYCLOALKYL OR CYCLOALKENYL HALIDE TIMCC, ZFX, TSNAX GAA 1520/4885LMNA 2952/4885ALDH1A1 3382/4885
US-20120029044-A1 7-AZONIABICYCLO[2.2.1]HEPTANE DERIVATIVES, METHODS OF PRODUCTION, AND PHARMACEUTICAL USES THEREOF CHRM3, CHRM2, CHRM1 GAA 3001/4885LMNA 3992/4885ALDH1A1 1222/4885

“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.