SCHEMBL973720

SCHEMBL973720

Cc1ccc(S(=O)(=O)ONC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
CA3 P07451 1/20 0.47
CA6 P23280 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CA5B Q9Y2D0 1/20 0.47
STAT3 P40763 1/20 0.47
F2 P00734 3/20 0.46
PRSS1 P07477 3/20 0.46
PRSS2 P07478 3/20 0.46
PRSS3 P35030 3/20 0.46
MEN1 O00255 2/20 0.46

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
SCHEMBL16897446 0.87 PKM (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL11794766 0.87 F2 (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL11798964 0.84 CA1 (0.43) CA1CA2MMP1MMP2MMP9
SCHEMBL7127537 0.83 ALDH1A1 (0.60) CA1CA2CA12CA9MEN1
SCHEMBL20085600 0.83 CA1 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL8634995 0.82 STAT3 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL9247417 0.81 MAPT (0.48) CA1CA2MMP1MMP2MMP9
SCHEMBL3179301 0.81 F2 (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL7128931 0.81 CA1 (0.56) CA1CA2CA12CA9CA6
SCHEMBL4951056 0.81 ALDH1A1 (0.54) CA1CA2CA12CA9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024069007-A2 IMMUNOSUPPRESSIVE COMPOUNDS UNIVERSITÄT BASEL (CH) 2024-04-04 WO disclosed
EP-4332089-A1 METHOD FOR PREPARING AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2024-03-06 EP disclosed
US-11021444-B2 Antiviral compounds Janssen Biopharma, Inc. (US) 2021-06-01 US disclosed
US-20190263754-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. (US) 2019-08-29 US disclosed
US-20180065932-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. 2018-03-08 US disclosed
EP-3262048-A1 ANTIVIRAL COMPOUNDS Alios Biopharma, Inc. (US) 2018-01-03 EP disclosed
US-9783512-B2 Bicyclic methylene aziridines and reactions thereof WISCONSIN ALUMI RESEARCH FOUNDATION (US) 2017-10-10 US disclosed
WO-2016138158-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. (US) 2016-09-01 WO disclosed
EP-3036220-A1 ANTIVIRAL COMPOUNDS Alios Biopharma, Inc. (US) 2016-06-29 EP disclosed
US-20160075668-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION 2016-03-17 US disclosed
WO-2015026792-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. (US) 2015-02-26 WO disclosed
US-20130079511-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-03-28 US disclosed
WO-2013033245-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-03-07 WO disclosed
US-8304553-B2 Method of forming oseltamivir and derivatives thereof NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2012-11-06 US disclosed
US-20120101271-A1 DIAMINE SYNTHESIS VIA CATALYTIC C-H AMINATION OF AZIDES NATIONAL SCIENCE FOUNDATION 2012-04-26 US disclosed
US-7956193-B2 Intramolecular C-H amination with sulfonyl azides UNIVERSITY OF SOUTH FLORIDA (US) 2011-06-07 US disclosed
US-20110021762-A1 METHOD OF FORMING OSELTAMIVIR AND DERIVATIVES THEREOF NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2011-01-27 US disclosed
US-20100063277-A1 Intramolecular C-H amination with sulfonyl azides NATIONAL SCIENCE FOUNDATION 2010-03-11 US disclosed
WO-2009078813-A1 METHOD OF FORMING OSELTAMIVIR AND DERIVATIVES THEREOF NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2009-06-25 WO disclosed
US-7385064-B1 Catalysts for use in enantioselective synthesis THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2008-06-10 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 (8 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-20190263754-A1 ANTIVIRAL COMPOUNDS MAVS, SARS1, ZC3HAV1 CA1 4791/4885CA2 3830/4885MMP1 4107/4885
US-11021444-B2 Antiviral compounds MAVS, SARS1, ZC3HAV1 CA1 4791/4885CA2 3830/4885MMP1 4107/4885
US-20100063277-A1 Intramolecular C-H amination with sulfonyl azides TST, TIMM9, PPOX CA1 2591/4885CA2 1273/4885MMP1 4650/4885
US-20180065932-A1 ANTIVIRAL COMPOUNDS MAVS, SARS1, ZC3HAV1 CA1 4791/4885CA2 3830/4885MMP1 4107/4885
US-20160075668-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF AAAS, CYCS, AOC2 CA1 3618/4885CA2 4187/4885MMP1 3845/4885
US-20110021762-A1 METHOD OF FORMING OSELTAMIVIR AND DERIVATIVES THEREOF AOC1, ALK, ALDH3A1 CA1 632/4885CA2 401/4885MMP1 1571/4885
US-20120101271-A1 DIAMINE SYNTHESIS VIA CATALYTIC C-H AMINATION OF AZIDES DOHH, AOC1, ESD CA1 777/4885CA2 745/4885MMP1 3980/4885
US-20130079511-A1 BICYCLIC METHYLENE AZIRIDINES AND REACTIONS THEREOF AAAS, CYCS, AOC2 CA1 3618/4885CA2 4187/4885MMP1 3845/4885

“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.