SCHEMBL826219

SCHEMBL826219

O=C(NCc1ccc(F)cc1)c1nc2ccc(S(=O)(=O)N3CCOCC3)cn2c(=O)c1O

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
NAMPT P43490 6/20 0.52
ALOX15 P16050 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
POLB P06746 2/20 0.47
TP53 P04637 2/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL823395 0.84 CYP2C9 (0.51) NAMPTSMN1; SMN2HSD17B10TP53KMT2A
SCHEMBL826244 0.83 CA2 (0.48) LMNASMN1; SMN2KMT2A
SCHEMBL826094 0.81 KCNH2 (0.52) SMN1; SMN2KMT2A
SCHEMBL825681 0.80 KDM4E (0.47) LMNANAMPTSMN1; SMN2HSD17B10KMT2A
SCHEMBL1880482 0.78 TP53 (0.46) LMNASMN1; SMN2HSD17B10TP53KMT2A
SCHEMBL823368 0.77 CYP2C9 (0.55) SMN1; SMN2HSD17B10POLBTP53KMT2A
SCHEMBL823326 0.77 SMN1; SMN2 (0.47) SMN1; SMN2HSD17B10KMT2A
SCHEMBL823370 0.77 KCNE1 (0.49) LMNASMN1; SMN2POLBTP53KMT2A
SCHEMBL823513 0.77 ERCC1 (0.48) SMN1; SMN2HSD17B10KMT2A
SCHEMBL825937 0.77 CYP2C9 (0.51) LMNASMN1; SMN2

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 LMNA 2777/4885NAMPT 52/4885ALOX15 1481/4885
US-20120232035-A1 Bicyclic pyrimidinones and uses thereof TPMT, TYMP, DPYD LMNA 2777/4885NAMPT 52/4885ALOX15 1481/4885
US-20110009366-A1 BICYCLIC PYRIMIDINONES AND USES THEREOF TPMT, TYMP, DPYD LMNA 2777/4885NAMPT 52/4885ALOX15 1481/4885

“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.