SCHEMBL3696907

SCHEMBL3696907

Cc1cnc2c(-c3ccc(F)c(C)c3)c(NC(=O)CC34CC5CC(CC(C5)C3)C4)nn2c1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 9/20 0.69
KCNQ2 O43526 9/20 0.69
P2RX7 Q99572 3/20 0.43
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX2 P34913 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL3695823 0.81 KCNQ3 (0.73) KCNQ3KCNQ2LMNA
SCHEMBL3707506 0.80 KCNQ3 (0.84) KCNQ3KCNQ2
SCHEMBL3707082 0.80 KCNQ3 (1.00) KCNQ3KCNQ2SMN1; SMN2MEN1KMT2A
SCHEMBL3700639 0.79 KCNQ3 (0.98) KCNQ3KCNQ2SMN1; SMN2MEN1KMT2A
SCHEMBL3697384 0.79 KCNQ3 (0.77) KCNQ3KCNQ2
SCHEMBL3702411 0.79 KCNQ3 (0.78) KCNQ3KCNQ2
SCHEMBL3706572 0.78 KCNQ3 (0.74) KCNQ3KCNQ2
SCHEMBL3712494 0.77 KCNQ3 (0.81) KCNQ3KCNQ2
SCHEMBL3710535 0.73 KCNQ3 (0.64) KCNQ3KCNQ2LMNASMN1; SMN2MEN1
SCHEMBL3709247 0.73 KCNQ3 (0.87) KCNQ3KCNQ2SMN1; SMN2MEN1KMT2A

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 2/4885P2RX7 184/4885

“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.