SCHEMBL1925443

SCHEMBL1925443

CC(=O)ON(C(=O)O)S(=O)(=O)c1ccccc1S(C)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ALOX15 P16050 1/20 0.41
BCAT2 O15382 1/20 0.39
HSD11B1 P28845 1/20 0.36
BMP1 P13497 1/20 0.36
BAZ2B Q9UIF8 3/20 0.34
BAZ2A Q9UIF9 3/20 0.34
BRD9 Q9H8M2 2/20 0.34
ITGAV P06756 1/20 0.34
ALDH1A1 P00352 2/20 0.33
EED O75530 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL1950189 0.85 ITGAV (0.40) KMT2ABCAT2HSD11B1BMP1ITGAV
SCHEMBL1949476 0.85 HSD11B1 (0.38) KMT2AMEN1BCAT2HSD11B1BMP1
SCHEMBL1927510 0.84 BMP1 (0.37) BCAT2HSD11B1BMP1ITGAVALDH1A1
SCHEMBL1926036 0.84 HSD11B1 (0.40) KMT2AMEN1BCAT2HSD11B1BMP1
SCHEMBL1925919 0.83 L3MBTL1 (0.48) KMT2AMEN1ALOX15HSD11B1TDP1
SCHEMBL1952111 0.82 MEN1 (0.38) KMT2AMEN1ALOX15BCAT2HSD11B1
SCHEMBL1948945 0.81 CTDSP1 (0.37) KMT2AMEN1ALOX15HSD11B1BMP1
SCHEMBL1952112 0.81 BMP1 (0.38) BCAT2HSD11B1BMP1ITGAVTDP1
SCHEMBL1948946 0.81 BMP1 (0.38) KMT2AMEN1BCAT2BMP1BAZ2B
SCHEMBL1948801 0.81 ALDH1A1 (0.48) KMT2ABMP1ALDH1A1TDP1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458127-B2 Bis-acylated hydroxylamine derivatives CARDIOXYL PHARMACEUTICALS, INC. (US) 2016-10-04 US claimed
EP-2509941-B1 N-ACYLATED HYDROXYLAMINE DERIVATIVES AND O-ACYLATED HYDROXYLAMINE DERIVATIVES UNIV JOHNS HOPKINS (US) 2019-01-23 EP disclosed
US-20180050985-A1 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES THE JOHNS HOPKINS UNIVERSITY 2018-02-22 US disclosed
US-9458127-B2 Bis-acylated hydroxylamine derivatives CARDIOXYL PHARMACEUTICALS, INC. (US) 2016-10-04 US disclosed
US-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives THE JOHNS HOPKINS UNIVERSITY 2015-07-16 US disclosed
US-9018411-B2 Bis-acylated hydroxylamine derivatives CARDIOXYL PHARMACEUTICALS, INC. (US) 2015-04-28 US disclosed
US-20140235636-A1 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES CARDIOXYL PHARMACEUTICALS, INC. (US) 2014-08-21 US disclosed
EP-2509942-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES Johns Hopkins University (US) 2012-10-17 EP disclosed
WO-2011071951-A2 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed
US-20110144067-A1 N-Acyloxysulfonamide and N-Hydroxy-N-Acylsulfonamide Derivatives THE JOHNS HOPKINS UNIVERSITY 2011-06-16 US disclosed
US-20110136827-A1 Bis-Acylated Hydroxylamine Derivatives THE JOHNS HOPKINS UNIVERSITY 2011-06-09 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 (5 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-20140235636-A1 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES TNNI3, TNNT2, TNNC1 KMT2A 1413/4885MEN1 3214/4885ALOX15 367/4885
US-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives CPT1A, TNNI3, NOS2 KMT2A 580/4885MEN1 3253/4885ALOX15 545/4885
US-20180050985-A1 N-ACYLOXYSULFONAMIDE AND N-HYDROXY-N-ACYLSULFONAMIDE DERIVATIVES TNNI3, TNNT2, NOS2 KMT2A 1464/4885MEN1 3326/4885ALOX15 351/4885
US-20110144067-A1 N-Acyloxysulfonamide and N-Hydroxy-N-Acylsulfonamide Derivatives TNNI3, TNNT2, TNNC1 KMT2A 1413/4885MEN1 3214/4885ALOX15 367/4885
US-20110136827-A1 Bis-Acylated Hydroxylamine Derivatives CPT1A, TNNI3, NOS2 KMT2A 580/4885MEN1 3253/4885ALOX15 545/4885

“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.