SCHEMBL823371

SCHEMBL823371

O=c1c(O)c(-c2nnc(Cc3ccc(Cl)c(Cl)c3)o2)nc2ccc(N3CCOCC3)cn12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I3 Q14994 1/20 0.45
SLC2A1 P11166 3/20 0.43
PIK3C2B O00750 1/20 0.40
PIK3CD O00329 1/20 0.37
PIK3CB P42338 1/20 0.37
LMNA P02545 2/20 0.37
STAT6 P42226 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DGAT1 O75907 1/20 0.37
APLNR P35414 1/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
MCL1 Q07820 1/20 0.36
POLB P06746 1/20 0.36
ALOX5 P09917 1/20 0.35
GRM2 Q14416 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL823391 0.88 TP53 (0.43) SLC2A1LMNASTAT6SMN1; SMN2MAPT
SCHEMBL823620 0.84 NR1I3 (0.45) NR1I3SLC2A1PIK3C2BPIK3CDPIK3CB
SCHEMBL1222145 0.84 SLC2A1 (0.43) NR1I3SLC2A1PIK3C2BPIK3CDPIK3CB
SCHEMBL823359 0.84 NR1I3 (0.49) NR1I3LMNASMN1; SMN2APLNRMAPT
SCHEMBL823372 0.82 NR1I3 (0.45) NR1I3SLC2A1PIK3C2BPIK3CDPIK3CB
SCHEMBL823424 0.80 SLC2A1 (0.42) SLC2A1PIK3C2BPIK3CDPIK3CBLMNA
SCHEMBL1220967 0.76 SLC2A1 (0.44) SLC2A1LMNASMN1; SMN2MAPTHTT
SCHEMBL823404 0.75 SLC2A1 (0.46) SLC2A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL823382 0.75 ERCC1 (0.45) SLC2A1LMNAMAPTKMT2AMEN1
SCHEMBL1221953 0.73 SLC2A1 (0.42) SLC2A1LMNASTAT6KMT2AMEN1

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859563-B2 Bicyclic pyrimidinones and uses thereof AVEXA LIMITED (AU) 2014-10-14 US disclosed
US-8859563-B2 Bicyclic pyrimidinones and uses thereof AVEXA LIMITED (AU) 2014-10-14 US disclosed
EP-2759544-A1 Compounds having antiviral properties Avexa Limited (AU) 2014-07-30 EP disclosed
EP-2759544-A1 Compounds having antiviral properties Avexa Limited (AU) 2014-07-30 EP disclosed
EP-2212324-B1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LTD (AU) 2014-03-26 EP disclosed
EP-2212324-B1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LTD (AU) 2014-03-26 EP disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2013-03-07 US disclosed
EP-2269992-A1 Bicyclic pyrimidinones for the treatment of viral infections Avexa Limited (AU) 2011-01-05 EP disclosed
EP-2212324-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES Avexa Limited (AU) 2010-08-04 EP disclosed
US-20100168063-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2010-07-01 US disclosed
US-20100168063-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2010-07-01 US disclosed
US-20100168063-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2010-07-01 US disclosed
WO-2010000032-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2010-01-07 WO disclosed
WO-2010000032-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2010-01-07 WO disclosed
EP-2114903-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF Avexa Limited (AU) 2009-11-11 EP disclosed
WO-2008077188-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2008-07-03 WO disclosed
WO-2008077188-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2008-07-03 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 (2 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 NR1I3 958/4885SLC2A1 1705/4885PIK3C2B 2724/4885
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES ZC3HAV1, ACE, EIF2AK2 NR1I3 1131/4885SLC2A1 751/4885PIK3C2B 2133/4885

“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.