SCHEMBL884698

SCHEMBL884698

COc1ccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)c(OC)n1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 17/20 0.57
KCNH2 Q12809 8/20 0.57
BRD9 Q9H8M2 1/20 0.39
BRD7 Q9NPI1 1/20 0.39
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL2063076 0.86 KCNA5 (0.57) KCNA5KCNH2
SCHEMBL884335 0.86 KCNA5 (0.53) KCNA5KCNH2
SCHEMBL884659 0.80 KCNA5 (0.68) KCNA5KCNH2
SCHEMBL884744 0.77 KCNA5 (0.47) KCNA5KCNH2
SCHEMBL4977322 0.75 ALDH1A1 (0.38) KCNA5KCNH2BRD9BRD7ALDH1A1
SCHEMBL14536130 0.74 BRD9 (0.52) BRD9BRD7
SCHEMBL2062779 0.74 KCNA5 (1.00) KCNA5KCNH2TSHR
SCHEMBL884349 0.73 KCNA5 (0.74) KCNA5KCNH2TSHR
SCHEMBL2063707 0.73 KCNA5 (1.00) KCNA5KCNH2TSHR
SCHEMBL885471 0.73 KCNA5 (0.66) KCNA5KCNH2

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
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US claimed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP claimed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO claimed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 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-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885KCNH2 3/4885BRD9 1475/4885

“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.