SCHEMBL6594459

SCHEMBL6594459

COc1cc(Br)cc(C=Cc2cc(C=Cc3cc(Br)cc(OC)c3O)nc(O)n2)c1O

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
ERN1 O75460 8/20 0.56
APP P05067 2/20 0.48
MAPT P10636 3/20 0.45
LMNA P02545 1/20 0.45
IGF1R P08069 1/20 0.43
PRMT5 O14744 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
ALOX15 P16050 1/20 0.39
ALOX12 P18054 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
SCHEMBL6594455 1.00 MEN1 (0.60) MEN1KMT2AERN1APPMAPT
SCHEMBL6591204 0.92 MEN1 (0.56) MEN1KMT2AERN1APPMAPT
SCHEMBL6591201 0.92 MEN1 (0.56) MEN1KMT2AERN1APPMAPT
SCHEMBL6592755 0.80 MEN1 (0.53) MEN1KMT2AERN1APPMAPT
SCHEMBL6589718 0.80 MEN1 (0.53) MEN1KMT2AERN1APPMAPT
SCHEMBL6589713 0.80 MEN1 (0.53) MEN1KMT2AERN1APPMAPT
SCHEMBL6592751 0.80 MEN1 (0.53) MEN1KMT2AERN1APPMAPT
SCHEMBL4710116 0.80 MEN1 (0.71) MEN1KMT2AERN1APPMAPT
SCHEMBL4710115 0.80 MEN1 (0.71) MEN1KMT2AERN1APPMAPT
SCHEMBL6596145 0.77 MAPT (0.60) MEN1KMT2AERN1MAPTLMNA

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