SCHEMBL15880673

SCHEMBL15880673

O=C(O)c1cc(S(=O)(=O)NO)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
KDM4E B2RXH2 4/20 0.64
HSD17B10 Q99714 4/20 0.64
HPGD P15428 2/20 0.64
MEN1 O00255 6/20 0.63
KMT2A Q03164 6/20 0.63
POLB P06746 2/20 0.63
TSHR P16473 1/20 0.57
GAA P10253 2/20 0.55
CSNK2A1 P68400 1/20 0.52
PTGS2 P35354 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CYP2C9 P11712 2/20 0.50
PTPN5 P54829 1/20 0.50
CA12 O43570 1/20 0.50
ALOX5 P09917 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50

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
SCHEMBL2836625 0.84 ALDH1A1 (0.62) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL19346347 0.84 KDM4E (0.56) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL2825786 0.84 ALDH1A1 (0.62) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL11222668 0.80 ALDH1A1 (0.75) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL13614102 0.80 MEN1 (0.57) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL3527141 0.79 ALDH1A1 (0.70) ALDH1A1KDM4EHSD17B10HPGDMEN1
Sulfosalicylic SCHEMBL29364125 0.79 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10HPGDMEN1
Sulfosalicylic SCHEMBL6717073 0.79 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10HPGDMEN1
Sulfosalicylic SCHEMBL34766 0.79 ALDH1A1 (0.96) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL3504223 0.79 ALDH1A1 (0.65) ALDH1A1KDM4EHSD17B10HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110179777-B Pharmaceutical compositions comprising nitroxyl donors 卡尔迪奥克斯尔制药公司 2022-07-15 CN disclosed
US-11304924-B2 Pharmaceutical compositions comprising nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2022-04-19 US disclosed
US-11083704-B2 Method of administering nitroxyl donating compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-10 US disclosed
EP-3427728-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS INC (US) 2021-07-07 EP disclosed
EP-3427728-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS INC (US) 2021-07-07 EP disclosed
US-20200163929-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. 2020-05-28 US disclosed
US-20200163929-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. 2020-05-28 US disclosed
US-10548872-B2 Pharmaceutical compositions comprising nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2020-02-04 US disclosed
US-10548872-B2 Pharmaceutical compositions comprising nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2020-02-04 US disclosed
US-20190343790-A1 METHOD OF ADMINISTERING NITROXYL DONATING COMPOUNDS CARDIOXYL PHARMACEUTICALS, INC. 2019-11-14 US disclosed
WO-2018128999-A1 METHOD OF ADMINISTERING NITROXYL DONATING COMPOUNDS CARDIOXYL PHARMACEUTICALS, INC. (US) 2018-07-12 WO disclosed
US-20150366977-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. 2015-12-24 US disclosed
US-20150366977-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. 2015-12-24 US disclosed
US-20150366977-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. 2015-12-24 US disclosed
CN-105142627-A Pharmaceutical compositions comprising nitroxyl donors CARDIOXYL PHARMACEUTICALS INC 2015-12-09 CN disclosed
EP-2945621-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS Cardioxyl Pharmaceuticals, Inc. (US) 2015-11-25 EP disclosed
WO-2014113700-A9 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. (US) 2014-10-09 WO disclosed
WO-2014113700-A9 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. (US) 2014-10-09 WO disclosed
WO-2014113700-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. (US) 2014-07-24 WO disclosed
WO-2014113700-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS, INC. (US) 2014-07-24 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 (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-10548872-B2 Pharmaceutical compositions comprising nitroxyl donors TNNT2, TNNI3, NQO1 ALDH1A1 954/4885KDM4E 1476/4885HSD17B10 418/4885
US-20200163929-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS TNNT2, TNNI3, NQO1 ALDH1A1 954/4885KDM4E 1476/4885HSD17B10 418/4885
US-20150366977-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS TNNT2, TNNI3, NQO1 ALDH1A1 954/4885KDM4E 1476/4885HSD17B10 418/4885
US-11083704-B2 Method of administering nitroxyl donating compounds NQO1, UGT1A3, NNMT ALDH1A1 513/4885KDM4E 1603/4885HSD17B10 712/4885
US-20190343790-A1 METHOD OF ADMINISTERING NITROXYL DONATING COMPOUNDS NQO1, UGT1A3, NNMT ALDH1A1 513/4885KDM4E 1603/4885HSD17B10 712/4885
US-11304924-B2 Pharmaceutical compositions comprising nitroxyl donors TNNT2, TNNI3, NQO1 ALDH1A1 954/4885KDM4E 1476/4885HSD17B10 418/4885

“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.