SCHEMBL2180635

SCHEMBL2180635

CC(=O)c1c(OCCBr)c(OCCCc2ccccc2)c2ocnc2c1C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 5/20 0.36
DAGLA Q9Y4D2 1/20 0.35
KCNA2 P16389 1/20 0.35
KCNA5 P22460 1/20 0.35
KCNA1 Q09470 1/20 0.35
FAAH O00519 2/20 0.34
LMNA P02545 1/20 0.34
FFAR1 O14842 1/20 0.34
TSHR P16473 1/20 0.34
SCN9A Q15858 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 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
SCHEMBL2180079 0.90 KCNA3 (0.42) KCNA3DAGLASCN9A
SCHEMBL2180941 0.86 KCNA2 (0.46) KCNA3DAGLAKCNA2KCNA5KCNA1
SCHEMBL2180578 0.83 MEN1 (0.47) MEN1POLBKMT2A
SCHEMBL3608600 0.82 KCNA3 (0.51) KCNA3KCNA2KCNA5KCNA1
SCHEMBL13408305 0.78 KCNA3 (0.51) KCNA3KCNA2KCNA5KCNA1
SCHEMBL3611946 0.78 KCNA3 (0.52) KCNA3KCNA2KCNA5KCNA1
SCHEMBL3763110 0.76 PDE4D (0.43) KCNA3LMNAFFAR1TSHRSCN9A
SCHEMBL2176824 0.76 KCNA3 (0.34) KCNA3
SCHEMBL3613546 0.73 KCNA3 (0.52) KCNA3KCNA2KCNA5KCNA1
SCHEMBL14221359 0.72 KCNA3 (0.51) KCNA3KCNA2KCNA5KCNA1

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
US-8507539-B2 Potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2013-08-13 US disclosed
US-8507539-B2 Potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2013-08-13 US disclosed
US-8507539-B2 Potassium channel blockers and uses thereof BIONOMICS LIMITED (AU) 2013-08-13 US disclosed
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2011-07-07 US disclosed
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2011-07-07 US disclosed
US-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF BIONOMICS LIMITED (AU) 2011-07-07 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-20110166130-A1 NOVEL POTASSIUM CHANNEL BLOCKERS AND USES THEREOF KCNA3, KCNB1, KCNK3 KCNA3 1/4885DAGLA 4009/4885KCNA2 28/4885

“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.