SCHEMBL6595261

SCHEMBL6595261

COc1cc(C=Cc2cc(C(F)(F)F)[nH]c(=O)n2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 1.00
ALDH1A1 P00352 4/20 1.00
MAPT P10636 4/20 1.00
LMNA P02545 3/20 1.00
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
POLB P06746 3/20 0.58
GAA P10253 1/20 0.58
TNF P01375 3/20 0.51
NOD1 Q9Y239 3/20 0.51
RAB9A P51151 1/20 0.51
HPGD P15428 2/20 0.45
HTT P42858 2/20 0.45
HSPA1A P0DMV8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PSD A5PKW4 1/20 0.44
TUBB4A P04350 4/20 0.44
TUBB P07437 4/20 0.44
TUBA3C P0DPH7 4/20 0.44

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
SCHEMBL6595258 1.00 KDM4E (1.00) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597177 0.92 KDM4E (0.85) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597180 0.92 KDM4E (0.85) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6594347 0.89 MAPT (0.80) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6594343 0.89 MAPT (0.80) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6595939 0.86 ALDH1A1 (1.00) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6595936 0.86 ALDH1A1 (1.00) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597469 0.84 KDM4E (0.72) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6597464 0.84 KDM4E (0.72) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL6595484 0.83 KDM4E (0.81) KDM4EALDH1A1MAPTLMNAKMT2A

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
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP claimed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 EP disclosed