SCHEMBL6593751

SCHEMBL6593751

O=c1nc(C=Cc2cc(Br)cc(Br)c2O)cc(-c2ccccc2)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PIM1 P11309 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CLK1 P49759 1/20 0.41
GSK3B P49841 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
CSNK2A3 Q8NEV1 1/20 0.41
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
ERN1 O75460 1/20 0.39
MAPT P10636 2/20 0.39

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
SCHEMBL6593747 1.00 CDC7 (0.45) CDC7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6663559 0.82 POLB (0.37) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL6594950 0.80 ERN1 (0.45) KDM4EMEN1KMT2AERN1MAPT
SCHEMBL6594952 0.80 ERN1 (0.45) KDM4EMEN1KMT2AERN1MAPT
SCHEMBL6597902 0.79 CDC7 (0.48) CDC7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6597904 0.79 CDC7 (0.48) CDC7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6594962 0.79 ERN1 (0.44) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL6594964 0.79 ERN1 (0.44) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL6598618 0.76 KDM4E (0.57) CDC7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6598621 0.76 KDM4E (0.57) CDC7KDM4EALDH1A1HPGDHSD17B10

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