SCHEMBL691159

SCHEMBL691159

CCOC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 2/20 0.47
HTT P42858 1/20 0.46
PTPN11 Q06124 1/20 0.46
PPARA Q07869 4/20 0.46
PPARG P37231 1/20 0.46
HPGD P15428 3/20 0.45
RECQL P46063 1/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ALDH1A1 P00352 2/20 0.44
PTPN1 P18031 1/20 0.43
CA9 Q16790 1/20 0.43
MAPT P10636 1/20 0.43
EPHX2 P34913 1/20 0.43

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
SCHEMBL691789 0.86 SMN1; SMN2 (0.42) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL691500 0.80 HPGD (0.68) KDM4ESMN1; SMN2MAPK1HPGDRECQL
SCHEMBL16399046 0.80 NPSR1 (0.53) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL25397951 0.77 GAA (0.66) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL321802 0.77 GAA (0.64) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL25393959 0.75 SMN1; SMN2 (0.49) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL29082317 0.74 POLB (0.56) GAAKDM4ESMN1; SMN2MAPK1HTT
SCHEMBL29082301 0.74 SMN1; SMN2 (0.72) GAATDP1KDM4ESMN1; SMN2HTT
SCHEMBL1222782 0.74 SMN1; SMN2 (0.57) GAAKDM4ESMN1; SMN2HTTALDH1A1
SCHEMBL1353071 0.74 MAPK1 (0.57) KDM4ESMN1; SMN2MAPK1PTPN11PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560643-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES Institute for OneWorld Health (US) 2013-02-27 EP disclosed
US-20120136003-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH 2012-05-31 US disclosed
EP-2421528-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES Institute for OneWorld Health (US) 2012-02-29 EP disclosed
US-20110288103-A1 COMPOUNDS, COMPOSITIONS, AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH 2011-11-24 US disclosed
WO-2011133596-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH (US) 2011-10-27 WO disclosed
WO-2010123933-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH (US) 2010-10-28 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 (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-20120136003-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES CFTR, PKD1, PKD2 GAA 917/4885TDP1 4299/4885KDM4E 4302/4885
US-20110288103-A1 COMPOUNDS, COMPOSITIONS, AND METHODS COMPRISING 1,3,4-OXADIAZOLE DERIVATIVES ORAI1, ATP2A3, ANO1 GAA 989/4885TDP1 3832/4885KDM4E 3292/4885

“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.