SCHEMBL883609

SCHEMBL883609

CC(C)(C)CC(=O)Nc1c(C2CC2)nc2c(OC(C)(F)F)cccn2c1=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 10/20 0.35
KCNQ3 O43525 8/20 0.35
KCNQ4 P56696 1/20 0.35
KCNQ5 Q9NR82 1/20 0.35
GUCY1B2 O75343 5/20 0.34
GUCY1A2 P33402 5/20 0.34
GUCY1A1 Q02108 5/20 0.34
GUCY1B1 Q02153 5/20 0.34
MCHR1 Q99705 2/20 0.34
CNR2 P34972 1/20 0.33
SSTR4 P31391 1/20 0.33

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
SCHEMBL883428 0.86 SMN1; SMN2 (0.40) KCNQ2KCNQ3KCNQ4KCNQ5CNR2
SCHEMBL876309 0.85 KCNQ2 (0.36) KCNQ2KCNQ3KCNQ4KCNQ5GUCY1B2
SCHEMBL15106118 0.81 KCNQ2 (0.36) KCNQ2KCNQ3GUCY1B2GUCY1A2GUCY1A1
SCHEMBL876238 0.78 MCHR1 (0.39) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MCHR1
SCHEMBL875212 0.77 GUCY1B2 (0.34) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MCHR1
SCHEMBL875210 0.75 MCHR1 (0.37) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MCHR1
SCHEMBL883352 0.70 KCNQ3 (0.37) KCNQ2KCNQ3
SCHEMBL875449 0.69 SMN1; SMN2 (0.42) KCNQ2KCNQ3KCNQ4KCNQ5
SCHEMBL876018 0.69 PIK3CD (0.37) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MCHR1
SCHEMBL875494 0.68 KDM4E (0.50) KCNQ2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases PFIZER INC. (US) 2013-07-18 US disclosed
US-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases PFIZER INC. (US) 2013-07-18 US disclosed
WO-2012038850-A1 PYRIDMIDONES FOR TREATMENT OF POTASSIUM CHANNEL RELATED DISEASES PFIZER INC. (US) 2012-03-29 WO 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-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases KCNQ5, KCNQ1, KCNQ3 KCNQ2 4/4885KCNQ3 3/4885KCNQ4 7/4885

“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.