SCHEMBL3701258

SCHEMBL3701258

CC(C)(C)c1c(NC(=O)CC2CCCCC2)nn2cccnc12

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 14/20 0.66
KCNQ2 O43526 14/20 0.66
EPHX2 P34913 2/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.40
ALPL P05186 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 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
SCHEMBL3713625 0.99 KCNQ3 (0.64) KCNQ3KCNQ2EPHX2HPGDRECQL
SCHEMBL3697377 0.90 KCNQ3 (0.68) KCNQ3KCNQ2HPGDMEN1ALPL
SCHEMBL3707951 0.89 KCNQ3 (0.67) KCNQ3KCNQ2HPGDMEN1POLB
SCHEMBL3701255 0.82 KCNQ3 (0.59) KCNQ3KCNQ2EPHX2MEN1ALPL
SCHEMBL3703349 0.81 KCNQ3 (0.65) KCNQ3KCNQ2HPGD
SCHEMBL3713577 0.81 KCNQ3 (0.45) KCNQ3KCNQ2HPGDMEN1KMT2A
SCHEMBL3713581 0.81 KCNQ3 (0.45) KCNQ3KCNQ2HPGDMEN1KMT2A
SCHEMBL3704952 0.81 KCNQ3 (0.48) KCNQ3KCNQ2
SCHEMBL3705767 0.81 ALDH1A1 (0.45) KCNQ3KCNQ2HPGDRECQL
SCHEMBL3704492 0.79 KCNQ3 (0.43) KCNQ3KCNQ2HPGDMEN1KMT2A

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.