SCHEMBL3697382

SCHEMBL3697382

Cc1cc(C)n2nc(NC(=O)CC3CCCC3)c(-c3cccc(Cl)c3)c2n1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 10/20 0.75
KCNQ2 O43526 10/20 0.75
EPHX2 P34913 1/20 0.47
CHRM1 P11229 1/20 0.43
HTR6 P50406 1/20 0.43
P2RX7 Q99572 1/20 0.41
KCNJ6 P48051 1/20 0.41
KCNJ5 P48544 1/20 0.41
KCNJ3 P48549 1/20 0.41
PTGER1 P34995 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL3705539 0.99 KCNQ3 (0.73) KCNQ3KCNQ2EPHX2CHRM1HTR6
SCHEMBL3704032 0.89 KCNQ3 (0.77) KCNQ3KCNQ2EPHX2MAPT
SCHEMBL3704938 0.89 KCNQ3 (0.74) KCNQ3KCNQ2EPHX2MAPTTSHR
SCHEMBL3699190 0.88 KCNQ3 (0.76) KCNQ3KCNQ2HTR6KCNJ6KCNJ5
SCHEMBL3705794 0.85 KCNQ3 (0.98) KCNQ3KCNQ2
SCHEMBL3700117 0.81 KCNQ3 (0.79) KCNQ3KCNQ2MAPTTSHRSMN1; SMN2
SCHEMBL3702142 0.80 KCNQ3 (0.76) KCNQ3KCNQ2TSHRHTTSMN1; SMN2
SCHEMBL3695312 0.78 KCNQ3 (0.80) KCNQ3KCNQ2KCNJ6KCNJ5KCNJ3
SCHEMBL3698696 0.78 RECQL (0.51) KCNQ3KCNQ2HTTHSD17B10
SCHEMBL3703612 0.76 KCNQ3 (0.77) KCNQ3KCNQ2

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 2/4885EPHX2 3661/4885

“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.