SCHEMBL3215571

SCHEMBL3215571

COC(=O)c1cc(S(C)(=O)=O)cc(I)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
CA9 Q16790 3/20 0.38
CA12 O43570 2/20 0.38
CA7 P43166 2/20 0.38
CA14 Q9ULX7 2/20 0.38
PDK2 Q15119 1/20 0.38
PDK4 Q16654 1/20 0.38
CFTR P13569 1/20 0.37
GAA P10253 3/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.37
XDH P47989 1/20 0.37
GFER P55789 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37

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
SCHEMBL8356473 0.84 MAPT (0.38) KDM4ESMN1; SMN2HSD17B10CA2CA1
SCHEMBL8354895 0.83 CA2 (0.41) KDM4ESMN1; SMN2HSD17B10CA2CFTR
SCHEMBL8354928 0.83 ALDH1A1 (0.42) KDM4ESMN1; SMN2HSD17B10CA2CA1
SCHEMBL7414215 0.82 KDM4E (0.45) KDM4ESMN1; SMN2HSD17B10CA2CA1
SCHEMBL14104505 0.81 LMNA (0.49) KDM4EHSD17B10LMNATDP1ALDH1A1
SCHEMBL16651363 0.80 TTR (0.48) CA2CA1CA9CA12CA7
SCHEMBL1809801 0.79 LMNA (0.46) KDM4ESMN1; SMN2HSD17B10CA2GAA
SCHEMBL1017860 0.79 KDM4E (0.45) KDM4ESMN1; SMN2HSD17B10CA2CA1
SCHEMBL7034885 0.78 TTR (0.54) KDM4ESMN1; SMN2HSD17B10CA2CA1
SCHEMBL30486727 0.78 TTR (0.54) KDM4ESMN1; SMN2HSD17B10CA2CA1

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
US-20100056527-A1 BENZOFURAN COMPOUNDS USEFUL IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED 2010-03-04 US disclosed
US-20100056527-A1 BENZOFURAN COMPOUNDS USEFUL IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED 2010-03-04 US disclosed
US-20100056527-A1 BENZOFURAN COMPOUNDS USEFUL IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR GLAXO GROUP LIMITED 2010-03-04 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-20100056527-A1 BENZOFURAN COMPOUNDS USEFUL IN THE TREATMENT OF CONDITIONS MEDIATED BY THE ACTION OF PGE2 AT THE EP1 RECEPTOR PTGER1, PTGER2, PTGER4 KDM4E 3664/4885SMN1; SMN2 1562/4885HSD17B10 1031/4885

“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.