SCHEMBL3702907

SCHEMBL3702907

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

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 14/20 0.61
KCNQ2 O43526 14/20 0.61
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.38
PIK3CG P48736 1/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL3703349 0.84 KCNQ3 (0.65) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3703825 0.81 KCNQ3 (0.59) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3700941 0.80 KCNQ3 (0.66) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3705797 0.80 KCNQ3 (0.60) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3705793 0.80 KCNQ3 (0.60) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3704939 0.79 KCNQ3 (0.59) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3704943 0.79 KCNQ3 (0.59) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3706645 0.77 KCNQ3 (0.46) KCNQ3KCNQ2SMN1; SMN2ALDH1A1PIK3CG
SCHEMBL3701756 0.76 KCNQ3 (1.00) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL3709516 0.76 KCNQ3 (0.67) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2

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 2/4885NPC1 493/4885

“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.