SCHEMBL6592151

SCHEMBL6592151

O=c1nc(C=Cc2c(O)ccc3ccccc23)cc[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
ALOX15 P16050 2/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ERN1 O75460 1/20 0.49
RIOK2 Q9BVS4 1/20 0.47
KDM4E B2RXH2 6/20 0.44
HTT P42858 4/20 0.44
NPC1 O15118 2/20 0.44
MAPT P10636 9/20 0.41
KMT2A Q03164 7/20 0.41
MEN1 O00255 6/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HIF1A Q16665 1/20 0.41
PAX8 Q06710 1/20 0.40
LMNA P02545 2/20 0.40

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
SCHEMBL7915280 0.77 ERN1 (0.70) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL7915285 0.77 ERN1 (0.70) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6591217 0.76 CDC7 (0.46) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6591213 0.76 CDC7 (0.46) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6594078 0.75 TNF (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6594074 0.75 TNF (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6594018 0.75 ECE2 (0.39) HTTNPC1MAPTKMT2AMEN1
SCHEMBL6594020 0.75 ECE2 (0.39) HTTNPC1MAPTKMT2AMEN1
SCHEMBL6595072 0.73 RIOK2 (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6595070 0.73 RIOK2 (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 WO claimed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP claimed
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 WO disclosed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP disclosed