SCHEMBL3706567

SCHEMBL3706567

COc1ccc(OC)c(CC(=O)Nc2nn3cccnc3c2-c2cccc(Cl)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 11/20 0.47
KCNQ2 O43526 11/20 0.47
IRAK4 Q9NWZ3 2/20 0.43
JAK2 O60674 2/20 0.41
FBP1 P09467 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GLS O94925 1/20 0.41
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
JAK1 P23458 1/20 0.40

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
SCHEMBL3703085 0.80 KCNQ3 (0.52) KCNQ3KCNQ2IRAK4JAK2KMT2A
SCHEMBL3700376 0.80 KCNQ2 (0.55) KCNQ3KCNQ2JAK2MEN1KMT2A
SCHEMBL3698144 0.77 KCNQ3 (0.53) KCNQ3KCNQ2IRAK4JAK2TP53
SCHEMBL3698754 0.76 KCNQ3 (0.53) KCNQ3KCNQ2JAK2JAK1
SCHEMBL3698068 0.75 KCNQ3 (0.49) KCNQ3KCNQ2MEN1KMT2AGLS
SCHEMBL3709317 0.75 CSNK1D (0.47) KCNQ3KCNQ2MEN1KMT2AGLS
SCHEMBL6126605 0.73 KCNQ3 (0.50) KCNQ3KCNQ2
SCHEMBL3706670 0.73 KCNQ3 (0.78) KCNQ3KCNQ2IRAK4JAK2MEN1
SCHEMBL3703211 0.72 KCNQ3 (0.54) KCNQ3KCNQ2JAK2KMT2A
SCHEMBL3700529 0.69 KCNQ3 (0.58) KCNQ3KCNQ2MEN1KMT2A

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-8609669-B2 Potassium channel modulators ABBVIE INC. (US) 2013-12-17 US claimed
WO-2012067822-A1 PYRAZOLO [1, 5 -A] PYRIMIDIN POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2012-05-24 WO claimed
US-20120122888-A1 Potassium Channel Modulators ABBOTT LABORATORIES (US) 2012-05-17 US claimed
US-8609669-B2 Potassium channel modulators ABBVIE INC. (US) 2013-12-17 US disclosed
WO-2012067822-A1 PYRAZOLO [1, 5 -A] PYRIMIDIN POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2012-05-24 WO disclosed
US-20120122888-A1 Potassium Channel Modulators ABBOTT LABORATORIES (US) 2012-05-17 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-20120122888-A1 Potassium Channel Modulators KCNQ1, KCNQ2, KCNJ2 KCNQ3 4/4885KCNQ2 2/4885IRAK4 1769/4885

“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.