SCHEMBL6595016

SCHEMBL6595016

Cc1cc(C=Cc2c(O)ccc3ccccc23)nc(O)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
ALOX15 P16050 2/20 0.51
TP53 P04637 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RIOK2 Q9BVS4 1/20 0.48
ERN1 O75460 1/20 0.46
KMT2A Q03164 10/20 0.45
MAPT P10636 9/20 0.44
THRB P10828 1/20 0.44
MEN1 O00255 8/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 2/20 0.44
GAA P10253 5/20 0.43
HPGD P15428 1/20 0.43
RRM1 P23921 2/20 0.43
HIF1A Q16665 1/20 0.42
GRM4 Q14833 1/20 0.41

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
SCHEMBL6595011 1.00 ALDH1A1 (0.51) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL7915285 0.78 ERN1 (0.70) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL7915280 0.78 ERN1 (0.70) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6595070 0.77 RIOK2 (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6595072 0.77 RIOK2 (0.57) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6593326 0.74 MAPT (0.48) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL6593322 0.74 MAPT (0.48) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL28503936 0.71 RRM1 (0.63) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6591213 0.69 CDC7 (0.46) ALDH1A1ALOX15TP53CYP1A2CYP2C9
SCHEMBL6591217 0.69 CDC7 (0.46) 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