SCHEMBL6006407

SCHEMBL6006407

O=CNCS(=O)(=O)Nc1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.54
RECQL P46063 2/20 0.51
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
HSD17B10 Q99714 3/20 0.47
HPGD P15428 3/20 0.47
KMT2A Q03164 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 3/20 0.46
BCHE P06276 1/20 0.44
LMNA P02545 3/20 0.40
GAA P10253 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MCL1 Q07820 1/20 0.39
HTT P42858 1/20 0.39
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39

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
SCHEMBL2128507 0.78 KEAP1 (0.68) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL6006400 0.78 KEAP1 (0.54) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL6005160 0.77 KEAP1 (0.53) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL3860044 0.76 KEAP1 (0.56) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL10808948 0.74 KEAP1 (0.57) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL10780391 0.74 KEAP1 (0.71) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL6005274 0.74 KEAP1 (0.71) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL6008160 0.73 CA2 (0.45) KEAP1ALDH1A1HPGDKMT2AMEN1
SCHEMBL28992058 0.71 KEAP1 (0.57) KEAP1RECQLALDH1A1KDM4EHSD17B10
SCHEMBL6005150 0.71 KEAP1 (0.53) KEAP1RECQLALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1207161-B1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2006-01-18 EP disclosed
US-6777410-B2 SUCH AS 9-(2-METHOXYPHENYL)-3-(1-METHYLETHYL)-(1,3)OXAZOLO-(2,3)ISOINDOLE-2,5(3H,9H)-DIONE; DIABETES AND COMPLICATIONS; OBESITY BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-08-17 US disclosed
US-20040053923-A1 Novel isoindole derivatives BANYU PHARMACEUTICAL CO., LTD. 2004-03-18 US disclosed
US-6608098-B1 Diabetes or obesity, 2-(4-(3-isopropyl-2,5-dioxo-2,3-dihydro-1H-pyrrolo(2,1-a) isoindol-9(5H)-yl)phenoxy)-N-propylacetamide BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-08-19 US disclosed
EP-1207161-A1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 EP 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-20040053923-A1 Novel isoindole derivatives GPR119, SLC5A2, SLC5A1 KEAP1 176/4885RECQL 4070/4885ALDH1A1 228/4885

“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.