SCHEMBL1919474

SCHEMBL1919474

Cc1ccc(S(=O)(=O)Oc2ccccc2I)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ESR1 P03372 2/20 0.44
GAA P10253 2/20 0.44
ESR2 Q92731 2/20 0.44
PTGS2 P35354 1/20 0.43
HSD11B1 P28845 1/20 0.40
HSD17B3 P37058 1/20 0.40
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
F2 P00734 2/20 0.38
MAPT P10636 2/20 0.38
IDO1 P14902 2/20 0.38
TDO2 P48775 2/20 0.38
LMNA P02545 2/20 0.37
KCNMA1 Q12791 2/20 0.37
MAPK1 P28482 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL28239839 0.78 MEN1 (0.55) KMT2AMEN1ESR1GAAESR2
SCHEMBL2461728 0.78 CA2 (0.36) KMT2AMEN1ESR1GAAESR2
SCHEMBL1360782 0.76 MEN1 (0.39) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL2516102 0.75 LMNA (0.56) KMT2AMEN1ESR1GAAESR2
SCHEMBL2461723 0.75 LMNA (0.34) LMNACA1CA2CA9TRPA1
SCHEMBL20746493 0.73 TRPA1 (0.45) KMT2AMEN1KDM4EALDH1A1F2
SCHEMBL29284823 0.71 ALDH1A1 (0.56) KMT2AMEN1ESR1GAAESR2
SCHEMBL19125575 0.71 KMT2A (0.50) KMT2AMEN1ESR1GAAESR2
SCHEMBL28134701 0.70 LMNA (0.45) KMT2AMEN1ESR1ESR2PTGS2
SCHEMBL17448355 0.70 CA2 (0.41) KMT2AMEN1GAAPTGS2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2365974-B1 FLUORINATED BENZOTHIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND IMAGING AGENT FOR DIAGNOSING ALTZHEIMER'S DISEASE USING THE SAME SNU R&DB FOUNDATION (KR) 2013-12-25 EP claimed
US-20110250136-A1 FLUORINATED BENZOTHIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND IMAGING AGENT FOR DIAGNOSING ALTZHEIMER'S DISEASE USING THE SAME SNU R&DB FOUNDATION (KR) 2011-10-13 US claimed
EP-2365974-A1 FLUORINATED BENZOTHIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND IMAGING AGENT FOR DIAGNOSING ALTZHEIMER'S DISEASE USING THE SAME SNU R&DB Foundation (KR) 2011-09-21 EP claimed
WO-2010053218-A1 FLUORINATED BENZOTHIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND IMAGING AGENT FOR DIAGNOSING ALTZHEIMER'S DISEASE USING THE SAME SNU R&DB FOUNDATION (KR) 2010-05-14 WO claimed
WO-2009049837-A1 PROCESS FOR PREPARING 8-HYDRAZINO-8-ARYLOCTANOYL DERIVATIVES AND THEIR USE REUTER CHEMISCHER APPARATEBAU KG (DE) 2009-04-23 WO claimed
US-5073643-A High yield synthesis of hydroxyl-containing cationic photoinitiators POLYSET CORPORATION (US) 1991-12-17 US claimed
US-9850218-B2 Thiazole compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2017-12-26 US disclosed
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-05-12 US disclosed
US-9073942-B2 Antiviral compounds with a heterotricycle moiety LUPIN LIMITED (IN) 2015-07-07 US disclosed
US-20150010504-A1 Antiviral Compounds with a Heterotricycle Moiety LUPIN LIMITED (IN) 2015-01-08 US disclosed
EP-2812327-A1 ANTIVIRAL COMPOUNDS WITH A HETEROTRICYCLE MOIETY Lupin Limited (IN) 2014-12-17 EP disclosed
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 US disclosed
EP-2341054-B1 Process for the synthesis of HMG-CoA reductase inhibitors LEK PHARMACEUTICALS (SI) 2014-06-25 EP disclosed
EP-0618907-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS Knoll AG (DE) 1994-10-12 EP disclosed
US-5340898-A A mixtures comprising an ionic onium borate photoinitiators; nontoxic RHONE-POULENC CHIMIE (FR) 1994-08-23 US disclosed
WO-1994005617-A1 SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES NEW YORK UNIVERSITY (US) 1994-03-17 WO disclosed
US-5079378-A Cationic polymerization, inproved solubility POLYSET CORPORATION (US) 1992-01-07 US disclosed
EP-0210589-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE ALPHA-HALOGEN KETALS ZAMBON S.p.A. (IT) 1990-09-26 EP disclosed
US-4861903-A Intermediates for preparing optically active carboxylic acids ZAMBON SPA (IT) 1989-08-29 US disclosed
EP-0210589-A2 Process for preparing optically active alpha-halogen ketals ZAMBON S.p.A. (IT) 1987-02-04 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 (4 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-20110250136-A1 FLUORINATED BENZOTHIAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND IMAGING AGENT FOR DIAGNOSING ALTZHEIMER'S DISEASE USING THE SAME APBA1, APP, PSEN1 KMT2A 3742/4885MEN1 2352/4885ESR1 2326/4885
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS TTR, PPARG, PPARD KMT2A 4254/4885MEN1 1314/4885ESR1 1788/4885
US-20150010504-A1 Antiviral Compounds with a Heterotricycle Moiety HCCS, UQCRB, HAVCR2 KMT2A 4564/4885MEN1 2743/4885ESR1 3548/4885
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS TTR, PPARG, PPARD KMT2A 4254/4885MEN1 1314/4885ESR1 1788/4885

“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.