SCHEMBL1613643

SCHEMBL1613643

Cc1nn2c(=O)cc(C(F)(F)F)[nH]c2c1-c1cccs1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.41
HPGD P15428 6/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 7/20 0.41
GAA P10253 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
RXFP1 Q9HBX9 1/20 0.39
PLAT P00750 1/20 0.38
KCNQ3 O43525 2/20 0.37
KCNQ2 O43526 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
PARP1 P09874 1/20 0.37
GLA P06280 2/20 0.36

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
SCHEMBL1615005 0.89 ALDH1A1 (0.38) KDM4EHPGDLMNAHSD17B10ALDH1A1
SCHEMBL1279265 0.87 SMN1; SMN2 (0.41) KDM4EHPGDKMT2ALMNAMEN1
SCHEMBL1278817 0.84 SMN1; SMN2 (0.39) KDM4EHPGDKMT2ALMNAMEN1
SCHEMBL1613652 0.84 PARP1 (0.40) KDM4EHPGDLMNAHSD17B10ALDH1A1
SCHEMBL1279413 0.82 SMN1; SMN2 (0.36) KDM4EHPGDKMT2ALMNAMEN1
SCHEMBL1279158 0.81 ADORA3 (0.39) KDM4EHPGDKMT2AMEN1HTT
SCHEMBL1614756 0.81 KDM4E (0.50) KDM4EHPGDKMT2ALMNAMEN1
SCHEMBL1613744 0.80 PARP1 (0.37) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL1613668 0.79 ADORA3 (0.39) KDM4EHPGDKMT2ALMNAMEN1
SCHEMBL1278649 0.79 KDM4E (0.39) KDM4EHPGDKMT2ALMNAMEN1

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 2 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-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 KDM4E 1364/4885HPGD 569/4885KMT2A 1353/4885

“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.