SCHEMBL3700529

SCHEMBL3700529

O=C(Cc1ccccc1)Nc1nn2cccnc2c1-c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 13/20 0.58
KCNQ2 O43526 13/20 0.58
KMT2A Q03164 2/20 0.49
CACNA1G O43497 1/20 0.49
CACNA1H O95180 1/20 0.49
CACNA1I Q9P0X4 1/20 0.49
MAPK14 Q16539 1/20 0.47
TMIGD3 P0DMS9 1/20 0.47
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
NPY5R Q15761 1/20 0.46
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL3704262 0.93 KCNQ3 (0.56) KCNQ3KCNQ2KMT2AMAPK14NPC1
SCHEMBL3702539 0.90 KCNQ3 (0.52) KCNQ3KCNQ2KMT2AALDH1A1
SCHEMBL3700376 0.89 KCNQ2 (0.55) KCNQ3KCNQ2KMT2ACACNA1GCACNA1H
SCHEMBL3705629 0.88 KCNQ3 (0.55) KCNQ3KCNQ2KMT2ANPC1RAB9A
SCHEMBL3703085 0.86 KCNQ3 (0.52) KCNQ3KCNQ2KMT2AALDH1A1
SCHEMBL3703285 0.86 KCNQ3 (0.53) KCNQ3KCNQ2KMT2AMAPK14MEN1
SCHEMBL3698144 0.85 KCNQ3 (0.53) KCNQ3KCNQ2
SCHEMBL6126263 0.84 KCNQ3 (0.50) KCNQ3KCNQ2
SCHEMBL3703211 0.84 KCNQ3 (0.54) KCNQ3KCNQ2KMT2AALDH1A1
SCHEMBL3703448 0.83 KCNQ3 (0.65) KCNQ3KCNQ2ALDH1A1

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 2/4885KMT2A 572/4885

“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.