SCHEMBL8224048

SCHEMBL8224048

O=[N+]([O-])c1ccccc1S(=O)(=O)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 1.00
CA2 P00918 1/20 1.00
MMP1 P03956 1/20 1.00
MMP2 P08253 1/20 1.00
MMP9 P14780 1/20 1.00
MMP8 P22894 1/20 1.00
MMP13 P45452 1/20 1.00
KMT2A Q03164 4/20 0.63
MEN1 O00255 3/20 0.63
F2 P00734 2/20 0.62
PRSS1 P07477 2/20 0.62
PRSS2 P07478 2/20 0.62
PRSS3 P35030 2/20 0.62
THRB P10828 1/20 0.62
TDP1 Q9NUW8 1/20 0.59
CYP19A1 P11511 1/20 0.56
GAA P10253 3/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 1/20 0.56
PKM P14618 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
SCHEMBL17978560 0.84 CA1 (0.71) CA1CA2MMP1MMP2MMP9
SCHEMBL27962904 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL30339289 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL5810580 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL46064 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL30732635 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL648427 0.81 CA1 (0.69) CA1CA2MMP1MMP2MMP9
SCHEMBL2476078 0.81 CA1 (0.68) CA1CA2MMP1MMP2MMP9
SCHEMBL2476076 0.81 CA1 (0.68) CA1CA2MMP1MMP2MMP9
SCHEMBL4389696 0.80 KMT2A (0.71) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210053915-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS THE JOHNS HOPKINS UNIVERSITY 2021-02-25 US disclosed
US-10829445-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2020-11-10 US disclosed
US-20190144380-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS THE JOHNS HOPKINS UNIVERSITY 2019-05-16 US disclosed
US-10179765-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2019-01-15 US disclosed
US-9969684-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2018-05-15 US disclosed
US-20170305847-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS THE JOHNS HOPKINS UNIVERSITY 2017-10-26 US disclosed
US-9725410-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors THE JOHNS HOPKINS UNIVERSITY (US) 2017-08-08 US disclosed
EP-3124471-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS The Johns Hopkins University (US) 2017-02-01 EP disclosed
US-20170022154-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS THE JOHNS HOPKINS UNIVERSITY 2017-01-26 US disclosed
US-9487498-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors THE JOHNS HOPKINS UNIVERSITY (US) 2016-11-08 US disclosed
EP-2578568-A1 PROCESS FOR PREPARATION OF 3-SUBSTITUTED-4-FLUOROPYRROLIDINE DERIVATIVES Kyorin Pharmaceutical Co., Ltd. (JP) 2013-04-10 EP disclosed
US-20130085282-A1 METHOD FOR PRODUCING 3-SUBSTITUTED-4-FLUOROPYRROLIDINE DERIVATIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2013-04-04 US disclosed
CN-102695698-A Method for producing 3,4-disubstituted pyrrolidine derivative and production intermediate thereof KYORIN SEIYAKU KK 2012-09-26 CN disclosed
EP-2489350-A1 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors Johns Hopkins University School of Medicine (US) 2012-08-22 EP disclosed
US-20110306614-A1 N-Hydroxylsulfonamide Derivatives as New Physiologically Useful Nitroxyl Donors THE JOHNS HOPKINS UNIVERSITY (US) 2011-12-15 US disclosed
US-8030356-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2011-10-04 US disclosed
US-8030356-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2011-10-04 US disclosed
US-20070299107-A1 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors NATIONAL SCIENCE FOUNDATION 2007-12-27 US disclosed
US-20070299107-A1 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors NATIONAL SCIENCE FOUNDATION 2007-12-27 US disclosed
WO-2007109175-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE (US) 2007-09-27 WO 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 (9 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-20110306614-A1 N-Hydroxylsulfonamide Derivatives as New Physiologically Useful Nitroxyl Donors TNNI3, TNNC1, NME4 CA1 2599/4885CA2 1456/4885MMP1 2327/4885
US-20210053915-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS TNNI3, TNNC1, TNNT2 CA1 2645/4885CA2 1468/4885MMP1 2368/4885
US-10829445-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors TNNI3, TNNC1, TNNT2 CA1 2645/4885CA2 1468/4885MMP1 2368/4885
US-20190144380-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS TNNI3, TNNC1, TNNT2 CA1 2645/4885CA2 1468/4885MMP1 2368/4885
US-20070299107-A1 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors TNNI3, TNNC1, NME4 CA1 2599/4885CA2 1456/4885MMP1 2327/4885
US-20170022154-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS TNNI3, TNNC1, NME4 CA1 2599/4885CA2 1456/4885MMP1 2327/4885
US-10179765-B2 N-hydroxylsulfonamide derivatives as new physiologically useful nitroxyl donors TNNI3, TNNC1, TNNT2 CA1 2645/4885CA2 1468/4885MMP1 2368/4885
US-20130085282-A1 METHOD FOR PRODUCING 3-SUBSTITUTED-4-FLUOROPYRROLIDINE DERIVATIVE NGLY1, SYNJ1, PFAS CA1 2864/4885CA2 1987/4885MMP1 1170/4885
US-20170305847-A1 N-HYDROXYLSULFONAMIDE DERIVATIVES AS NEW PHYSIOLOGICALLY USEFUL NITROXYL DONORS TNNI3, TNNC1, NME4 CA1 2599/4885CA2 1456/4885MMP1 2327/4885

“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.