SCHEMBL3840101

SCHEMBL3840101

COC(=O)c1nc(-c2sccc2C=O)nc(O)c1O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 2/20 0.39
FEN1 P39748 2/20 0.39
ERCC4 Q92889 2/20 0.39
ERN1 O75460 8/20 0.36
RNASEH1 O60930 1/20 0.34
ALDH1A1 P00352 2/20 0.34
PTGS1 P23219 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL13646996 0.79 ALDH1A1 (0.40) ERCC1FEN1ERCC4ERN1ALDH1A1
SCHEMBL6620564 0.77 ERCC1 (0.61) ERCC1FEN1ERCC4RNASEH1
SCHEMBL4029963 0.76 ERCC1 (0.45) ERCC1FEN1ERCC4RNASEH1ALDH1A1
SCHEMBL13647162 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL3833902 0.74 ERCC1 (0.60) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL13647186 0.70 GAA (0.42) ALDH1A1NPSR1HTTHPGDSMN1; SMN2
SCHEMBL23467921 0.70 ERCC1 (0.56) ERCC1FEN1ERCC4RNASEH1ALDH1A1
SCHEMBL3838801 0.69 P2RX3 (0.37) ERCC1FEN1ERCC4KDM4ESMN1; SMN2
SCHEMBL13647166 0.69 MEN1 (0.40) RNASEH1ALDH1A1NPSR1KDM4EHPGD
SCHEMBL4907155 0.69 ALDH1A1 (0.50) ERCC1FEN1ERCC4ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309566-B1 DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2009-10-07 EP disclosed
EP-1309566-B1 DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2009-10-07 EP disclosed
US-7091209-B2 Dihydroxypyridmidine carboxylic acids as viral polymerase inhibitors MERCK & CO., INC. (US) 2006-08-15 US disclosed
US-20040106627-A1 Dihydroxypyrimidine carboxylic acids as viral polymerase inhibitors ISTITUTO DI RICHERCHE DI BIOLOGIA MOLECULARE P ANGELETTI SPA (IT) 2004-06-03 US disclosed
EP-1309566-A1 DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2003-05-14 EP disclosed
WO-2002006246-A1 DIHYDROXYPYRIMIDINE CARBOXYLIC ACIDS AS VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2002-01-24 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 (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-20040106627-A1 Dihydroxypyrimidine carboxylic acids as viral polymerase inhibitors DPYD, DUT, UMPS ERCC1 2410/4885FEN1 807/4885ERCC4 1146/4885

“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.