SCHEMBL826244

SCHEMBL826244

NS(=O)(=O)c1ccc2nc(C(=O)NCc3ccc(F)cc3)c(O)c(=O)n2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.48
CA1 P00915 8/20 0.48
CA9 Q16790 4/20 0.48
CA12 O43570 3/20 0.48
KCNH2 Q12809 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CA7 P43166 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
KCNE1 P15382 1/20 0.43
CCR1 P32246 1/20 0.43
KCNQ1 P51787 1/20 0.43
ERCC1 P07992 1/20 0.43
FEN1 P39748 1/20 0.43
ERCC4 Q92889 1/20 0.43
CYP2C9 P11712 1/20 0.42

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
SCHEMBL826094 0.87 KCNH2 (0.52) KCNH2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL826219 0.83 LMNA (0.58) KMT2ASMN1; SMN2LMNA
SCHEMBL823513 0.83 ERCC1 (0.48) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL823368 0.83 CYP2C9 (0.55) KCNH2MEN1KMT2ASMN1; SMN2KCNE1
SCHEMBL823370 0.83 KCNE1 (0.49) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL823326 0.83 SMN1; SMN2 (0.47) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL826625 0.81 SMN1; SMN2 (0.45) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL826202 0.80 CYP2C9 (0.49) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL1876737 0.80 SMN1; SMN2 (0.53) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL825937 0.79 CYP2C9 (0.51) KCNH2ALDH1A1SMN1; SMN2LMNAKCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232035-A1 Bicyclic pyrimidinones and uses thereof AVEXA LIMITED (AU) 2012-09-13 US disclosed
US-8207334-B2 Bicyclic pyrimidinones and uses thereof AVEXA LIMITED (AU) 2012-06-26 US disclosed
US-8143268-B2 Bicyclic pyrimidinones and uses thereof AVEXA LIMITED (AU) 2012-03-27 US disclosed
US-20110009366-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2011-01-13 US disclosed
EP-2269992-A1 Bicyclic pyrimidinones for the treatment of viral infections Avexa Limited (AU) 2011-01-05 EP disclosed
EP-2269992-A1 Bicyclic pyrimidinones for the treatment of viral infections Avexa Limited (AU) 2011-01-05 EP disclosed
US-20100168063-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2010-07-01 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 (3 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-20100168063-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF TPMT, TYMP, DPYD CA2 2871/4885CA1 2838/4885CA9 2442/4885
US-20120232035-A1 Bicyclic pyrimidinones and uses thereof TPMT, TYMP, DPYD CA2 2871/4885CA1 2838/4885CA9 2442/4885
US-20110009366-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF TPMT, TYMP, DPYD CA2 2871/4885CA1 2838/4885CA9 2442/4885

“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.