SCHEMBL6594565

SCHEMBL6594565

Oc1nccc(/C=C/c2c(Cl)cccc2Cl)n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.71
KDM4E B2RXH2 5/20 0.71
RAB9A P51151 6/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
ALDH1A1 P00352 3/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
NPC1 O15118 5/20 0.47
KMT2A Q03164 4/20 0.47
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
GRM4 Q14833 7/20 0.40
MEN1 O00255 2/20 0.39
HSP90AA1 P07900 1/20 0.39
AGTR1 P30556 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HPGD P15428 2/20 0.39
GAA P10253 1/20 0.39
NFKB1 P19838 1/20 0.39
RECQL P46063 1/20 0.39
NFKB2 Q00653 1/20 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
SCHEMBL6594571 1.00 MAPT (0.71) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL6593326 0.74 MAPT (0.48) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL6593322 0.74 MAPT (0.48) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL6595070 0.72 RIOK2 (0.57) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL6595072 0.72 RIOK2 (0.57) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL23957242 0.71 GRM4 (0.39) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL4710302 0.70 ALDH1A1 (0.58) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL4710298 0.70 ALDH1A1 (0.58) MAPTKDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL3128568 0.66
SCHEMBL6593788 0.66 TNF (0.48) RAB9ALMNAGRM4HDAC6NFKB1

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