SCHEMBL6592902

SCHEMBL6592902

COc1ccc(Cl)cc1-c1ccc(/C=C/c2cc(C(F)(F)F)[nH]c(=O)n2)o1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.69
KDM4E B2RXH2 6/20 0.69
MEN1 O00255 5/20 0.69
KMT2A Q03164 5/20 0.69
USP2 O75604 3/20 0.69
CRHBP P24387 1/20 0.69
CRHR2 Q13324 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
PSD A5PKW4 1/20 0.66
MAPT P10636 5/20 0.59
POLB P06746 4/20 0.59
HPGD P15428 4/20 0.59
LMNA P02545 3/20 0.59
HTT P42858 2/20 0.58
RECQL P46063 2/20 0.58
TLR9 Q9NR96 1/20 0.58
TNF P01375 3/20 0.53
NOD1 Q9Y239 3/20 0.53
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL6592904 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6593287 0.85 MEN1 (0.55) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6593283 0.85 MEN1 (0.55) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6594863 0.85 MEN1 (0.79) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6594860 0.85 MEN1 (0.79) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6593705 0.85 PSD (0.69) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6593707 0.85 PSD (0.69) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6594511 0.83 MEN1 (0.88) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6594515 0.83 MEN1 (0.88) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL6598777 0.82 MEN1 (1.00) ALDH1A1KDM4EMEN1KMT2AUSP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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