SCHEMBL1926047

SCHEMBL1926047

CC(C)[C@@H](C(=O)ON(C(=O)OC(C)(C)C)S(=O)(=O)c1ccccc1Br)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.40
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD11B1 P28845 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.34
PLAU P00749 1/20 0.33
ELANE P08246 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL2028960 0.89 TP53 (0.38) KMT2ATP53ALDH1A1HSD11B1MAPT
SCHEMBL1927386 0.82 NPSR1 (0.47) NPSR1KMT2AHSD11B1ATM
SCHEMBL1927383 0.78 NPSR1 (0.47) NPSR1KMT2AHSD11B1ATM
SCHEMBL1924577 0.78 NPSR1 (0.47) NPSR1KMT2AHSD11B1ATM
SCHEMBL2026706 0.77 NPSR1 (0.43) NPSR1KMT2ATP53ALDH1A1HSD11B1
SCHEMBL542373 0.77 TP53 (0.55) KMT2ATP53ALDH1A1MAPTKDM4E
SCHEMBL1926172 0.76 NPSR1 (0.47) NPSR1KMT2AHSD11B1ATM
SCHEMBL1925891 0.75 NPSR1 (0.49) NPSR1KMT2AHSD11B1ATM
SCHEMBL1925249 0.75 NPSR1 (0.47) NPSR1KMT2AHSD11B1ATM
SCHEMBL1925513 0.74 KMT2A (0.47) KMT2ATP53ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509941-A2 N-ACYLATED HYDROXYLAMINE DERIVATIVES AND O-ACYLATED HYDROXYLAMINE DERIVATIVES The 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20110144067-A1 N-Acyloxysulfonamide and N-Hydroxy-N-Acylsulfonamide Derivatives TNNI3, TNNT2, TNNC1 NPSR1 309/4885KMT2A 1413/4885TP53 814/4885

“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.