SCHEMBL3613537

SCHEMBL3613537

COc1ccc(COc2c(O)c(C(C)=O)c(C)c3ccoc23)cc1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA2 P16389 3/20 0.67
KCNA5 P22460 3/20 0.67
KCNA1 Q09470 3/20 0.67
KCNA4 P22459 2/20 0.67
KCNH2 Q12809 2/20 0.67
KCNA3 P22001 1/20 0.63

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
SCHEMBL3612862 0.82 KCNA3 (0.78) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL3613230 0.78 KCNA3 (0.51) KCNA2KCNA5KCNA1KCNA3
SCHEMBL13920855 0.77 KCNA3 (1.00) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL1344800 0.77 KCNA2 (0.89) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL3615123 0.76 KCNA3 (0.51) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL10884152 0.72 KCNA3 (0.80) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL10300858 0.72 ALDH1A1 (0.56) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL3189671 0.71 KCNA3 (1.00) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL12133188 0.71 KCNA3 (0.83) KCNA2KCNA5KCNA1KCNA4KCNH2
SCHEMBL3605592 0.71 KCNA2 (0.54) KCNA2KCNA5KCNA1KCNA3

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-8309545-B2 Benzofuran potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2012-11-13 US disclosed
US-8309545-B2 Benzofuran potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2012-11-13 US disclosed
US-8309545-B2 Benzofuran potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2012-11-13 US disclosed
US-20100087430-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2010-04-08 US disclosed
US-20100087430-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2010-04-08 US disclosed
US-20100087430-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2010-04-08 US disclosed
WO-2008040057-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2008-04-10 WO disclosed
WO-2008040057-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2008-04-10 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 (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-20100087430-A1 NOVEL BENZOFURAN POTASSIUM CHANNEL BLOCKERS AND USES THEREOF KCNA3, KCNB1, KCNK3 KCNA2 31/4885KCNA5 21/4885KCNA1 14/4885

“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.