SCHEMBL6594182

SCHEMBL6594182

O=C(O)c1ccc(-c2ccc(/C=C/c3cc(C(F)(F)F)[nH]c(=O)n3)o2)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.72
KMT2A Q03164 7/20 0.72
ALDH1A1 P00352 5/20 0.72
KDM4E B2RXH2 4/20 0.72
L3MBTL1 Q9Y468 3/20 0.72
USP2 O75604 2/20 0.72
CRHBP P24387 1/20 0.72
CRHR2 Q13324 1/20 0.72
PSD A5PKW4 1/20 0.69
POLB P06746 6/20 0.69
RECQL P46063 3/20 0.69
HTT P42858 2/20 0.69
TLR9 Q9NR96 1/20 0.69
MAPT P10636 5/20 0.67
LMNA P02545 3/20 0.67
HPGD P15428 2/20 0.67
TNF P01375 3/20 0.48
NOD1 Q9Y239 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
HSPA1A P0DMV8 1/20 0.45

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
SCHEMBL6594186 1.00 MEN1 (0.72) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6593389 0.93 KMT2A (0.72) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6593384 0.93 KMT2A (0.72) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6591443 0.88 MEN1 (0.70) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6591439 0.88 MEN1 (0.70) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6599744 0.87 ALDH1A1 (0.69) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6599741 0.87 ALDH1A1 (0.69) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6596295 0.86 PSD (0.77) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6596299 0.86 PSD (0.77) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL6591484 0.85 PSD (0.73) MEN1KMT2AALDH1A1KDM4EL3MBTL1

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