SCHEMBL876309

SCHEMBL876309

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

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 9/20 0.36
KCNQ3 O43525 8/20 0.36
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GUCY1B2 O75343 1/20 0.34
GUCY1A2 P33402 1/20 0.34
GUCY1A1 Q02108 1/20 0.34
GUCY1B1 Q02153 1/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KCNQ4 P56696 1/20 0.33
KCNQ5 Q9NR82 1/20 0.33
POLB P06746 1/20 0.33
PTGER1 P34995 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL883609 0.85 KCNQ2 (0.35) KCNQ2KCNQ3GUCY1B2GUCY1A2GUCY1A1
SCHEMBL15106118 0.85 KCNQ2 (0.36) KCNQ2KCNQ3HTTSMN1; SMN2GUCY1B2
SCHEMBL875449 0.85 SMN1; SMN2 (0.42) KCNQ2KCNQ3HTTSMN1; SMN2L3MBTL1
SCHEMBL875494 0.83 KDM4E (0.50) KCNQ2HTTL3MBTL1MAPTKDM4E
SCHEMBL875143 0.76 KDM4E (0.40) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MAPT
SCHEMBL875530 0.72 MAPT (0.37) HTTSMN1; SMN2MAPTKDM4ERECQL
SCHEMBL876306 0.69 SMN1; SMN2 (0.40) KCNQ2KCNQ3HTTSMN1; SMN2MAPT
SCHEMBL883428 0.69 SMN1; SMN2 (0.40) KCNQ2KCNQ3HTTSMN1; SMN2MAPT
SCHEMBL883703 0.67 LMNA (0.44) HTTSMN1; SMN2MAPTKDM4ETP53
SCHEMBL883352 0.67 KCNQ3 (0.37) KCNQ2KCNQ3SMN1; SMN2MAPTTP53

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
EP-2619202-A1 PYRIDMIDONES FOR TREATMENT OF POTASSIUM CHANNEL RELATED DISEASES Pfizer Inc (US) 2013-07-31 EP 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 3/4885HTT 886/4885

“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.