SCHEMBL1279360

SCHEMBL1279360

CC(C)(C)c1cc(=O)n2nc(C(F)(F)F)c(-c3cccc4ccccc34)c2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 4/20 0.48
KCNQ2 O43526 4/20 0.48
ARF6 P62330 5/20 0.39
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PSD A5PKW4 2/20 0.35
TYMP P19971 1/20 0.34
KDM4E B2RXH2 2/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK14 Q16539 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
SCHEMBL1278711 0.92 KCNQ3 (0.46) KCNQ3KCNQ2ARF6LMNAALDH1A1
SCHEMBL1279374 0.89 KCNQ3 (0.45) KCNQ3KCNQ2ARF6ALDH1A1PSD
SCHEMBL1614638 0.86 KCNQ3 (0.43) KCNQ3KCNQ2LMNAALDH1A1PSD
SCHEMBL1279353 0.84 KCNQ3 (0.43) KCNQ3KCNQ2ARF6PSDTYMP
SCHEMBL1279423 0.83 KCNQ3 (0.43) KCNQ3KCNQ2ARF6LMNAALDH1A1
SCHEMBL1614110 0.83 KCNQ3 (0.45) KCNQ3KCNQ2LMNAALDH1A1PSD
SCHEMBL1278758 0.82 KCNQ3 (0.49) KCNQ3KCNQ2ARF6PSDTYMP
SCHEMBL1279027 0.82 POLB (0.46) KCNQ3KCNQ2ARF6LMNAALDH1A1
SCHEMBL1279244 0.81 KCNQ3 (0.42) KCNQ3KCNQ2ARF6PSDTYMP
SCHEMBL1278970 0.80 ARF6 (0.52) KCNQ3KCNQ2ARF6PSDTYMP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796285-B2 Pyrazolo [1,5-a]-pyrimidones derivatives and pharmaceutical compositions and uses thereof HEBEI MEDICAL UNIVERSITY (CN) 2014-08-05 US disclosed
US-8796285-B2 Pyrazolo [1,5-a]-pyrimidones derivatives and pharmaceutical compositions and uses thereof HEBEI MEDICAL UNIVERSITY (CN) 2014-08-05 US disclosed
US-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof PEKING UNIVERSITY (CN) 2012-04-12 US disclosed
US-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof PEKING UNIVERSITY (CN) 2012-04-12 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-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof KCNJ2, KCNQ5, KCNJ11 KCNQ3 12/4885KCNQ2 9/4885ARF6 3851/4885

“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.