SCHEMBL3704032

SCHEMBL3704032

Cc1cc(C)n2nc(NC(=O)CC3CCCCC3)c(-c3ccc(Cl)cc3)c2n1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 9/20 0.77
KCNQ2 O43526 9/20 0.77
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
EPHX2 P34913 1/20 0.42

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
SCHEMBL3704938 0.90 KCNQ3 (0.74) KCNQ3KCNQ2MAPTKDM4EMEN1
SCHEMBL3705539 0.90 KCNQ3 (0.73) KCNQ3KCNQ2EPHX2
SCHEMBL3700117 0.90 KCNQ3 (0.79) KCNQ3KCNQ2MAPTKDM4EMEN1
SCHEMBL3697382 0.89 KCNQ3 (0.75) KCNQ3KCNQ2MAPTEPHX2
SCHEMBL3705794 0.88 KCNQ3 (0.98) KCNQ3KCNQ2
SCHEMBL3699190 0.84 KCNQ3 (0.76) KCNQ3KCNQ2MAPTMEN1KMT2A
SCHEMBL3695312 0.81 KCNQ3 (0.80) KCNQ3KCNQ2MEN1ALDH1A1KMT2A
SCHEMBL3703612 0.81 KCNQ3 (0.77) KCNQ3KCNQ2KDM4EPOLB
SCHEMBL3702142 0.80 KCNQ3 (0.76) KCNQ3KCNQ2KDM4EMEN1ALDH1A1
SCHEMBL3701966 0.78 KCNQ3 (0.56) KCNQ3KCNQ2MAPTKDM4EMEN1

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 2/4885MAPT 3131/4885

“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.