SCHEMBL6595459

SCHEMBL6595459

O=c1nc(/C=C/c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc(C(F)(F)F)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSD A5PKW4 1/20 0.68
MAPT P10636 10/20 0.66
MEN1 O00255 9/20 0.66
KMT2A Q03164 9/20 0.66
POLB P06746 6/20 0.66
LMNA P02545 5/20 0.66
HPGD P15428 3/20 0.66
ALDH1A1 P00352 9/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
TNF P01375 3/20 0.58
NOD1 Q9Y239 3/20 0.58
HTT P42858 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
HSPA1A P0DMV8 1/20 0.58
KDM4E B2RXH2 5/20 0.56
USP2 O75604 2/20 0.56
CRHBP P24387 1/20 0.56
CRHR2 Q13324 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
RECQL P46063 3/20 0.53

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
SCHEMBL6594257 1.00 PSD (0.68) PSDMAPTMEN1KMT2APOLB
SCHEMBL6595522 0.87 KMT2A (0.66) PSDMAPTMEN1KMT2APOLB
SCHEMBL6595519 0.87 KMT2A (0.66) PSDMAPTMEN1KMT2APOLB
SCHEMBL6596121 0.85 MAPT (0.76) PSDMAPTMEN1KMT2APOLB
SCHEMBL6596117 0.85 MAPT (0.76) PSDMAPTMEN1KMT2APOLB
SCHEMBL6596295 0.84 PSD (0.77) PSDMAPTMEN1KMT2APOLB
SCHEMBL6596299 0.84 PSD (0.77) PSDMAPTMEN1KMT2APOLB
SCHEMBL6592450 0.83 MAPT (0.69) PSDMAPTMEN1KMT2APOLB
SCHEMBL6592447 0.83 MAPT (0.69) PSDMAPTMEN1KMT2APOLB
SCHEMBL6592011 0.83 PSD (0.84) PSDMAPTMEN1KMT2APOLB

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 3 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
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