SCHEMBL6597397

SCHEMBL6597397

O=C(O)c1ccc(-c2ccc(C=Cc3cc(C(F)(F)F)[nH]c(=O)n3)o2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.77
KMT2A Q03164 6/20 0.77
MAPT P10636 6/20 0.77
POLB P06746 5/20 0.77
LMNA P02545 4/20 0.77
HPGD P15428 3/20 0.77
PSD A5PKW4 1/20 0.69
KDM4E B2RXH2 8/20 0.69
ALDH1A1 P00352 6/20 0.69
USP2 O75604 2/20 0.69
HTT P42858 2/20 0.69
RECQL P46063 2/20 0.69
TLR9 Q9NR96 1/20 0.69
L3MBTL1 Q9Y468 2/20 0.67
CRHBP P24387 1/20 0.67
CRHR2 Q13324 1/20 0.67
TNF P01375 3/20 0.47
NOD1 Q9Y239 3/20 0.47
RAB9A P51151 2/20 0.47
TDP1 Q9NUW8 3/20 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
SCHEMBL6597395 1.00 MEN1 (0.77) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6593877 0.89 POLB (0.68) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6593873 0.89 POLB (0.68) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6592402 0.87 MAPT (1.00) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6592407 0.87 MAPT (1.00) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6591439 0.86 MEN1 (0.70) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6591443 0.86 MEN1 (0.70) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6592007 0.86 PSD (0.84) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6592011 0.86 PSD (0.84) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL6593887 0.86 MEN1 (0.82) MEN1KMT2AMAPTPOLBLMNA

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