SCHEMBL1948466

SCHEMBL1948466

CC(=O)OCC(C)(C)N(C(=O)O)S(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 2/20 0.40
NR1H4 Q96RI1 7/20 0.37
HSD11B1 P28845 1/20 0.36
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL1951614 0.85 L3MBTL1 (0.34) POLBKMT2A
SCHEMBL1951247 0.77 L3MBTL1 (0.45) HSD11B1POLBKMT2AATM
SCHEMBL1950740 0.70 KMT2A (0.44) DAGLANR1H4HSD11B1POLBKMT2A
SCHEMBL14675574 0.69 HSD11B1 (0.42) DAGLANR1H4HSD11B1ATM
SCHEMBL2253608 0.67 DAGLA (0.45) DAGLANR1H4POLBKMT2ATP53
SCHEMBL1947913 0.66 MEN1 (0.60) DAGLANR1H4HSD11B1KMT2AATM
SCHEMBL12546649 0.66 MEN1 (0.43) DAGLANR1H4HSD11B1KMT2AATM
SCHEMBL12546583 0.66 KMT2A (0.43) DAGLANR1H4KMT2ATP53
SCHEMBL12546697 0.65 ALDH1A1 (0.47) DAGLANR1H4KMT2A
SCHEMBL1925797 0.64 HSD11B1 (0.43) DAGLANR1H4HSD11B1POLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives THE JOHNS HOPKINS UNIVERSITY 2015-07-16 US claimed
EP-2509942-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES Johns Hopkins University (US) 2012-10-17 EP claimed
WO-2011071947-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO claimed
US-20110136827-A1 Bis-Acylated Hydroxylamine Derivatives THE JOHNS HOPKINS UNIVERSITY 2011-06-09 US claimed
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-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 (2 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-20150197502-A1 Bis-Acylated Hydroxylamine Derivatives CPT1A, TNNI3, NOS2 DAGLA 2568/4885NR1H4 1002/4885HSD11B1 323/4885
US-20110136827-A1 Bis-Acylated Hydroxylamine Derivatives CPT1A, TNNI3, NOS2 DAGLA 2568/4885NR1H4 1002/4885HSD11B1 323/4885

“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.