SCHEMBL5265071

SCHEMBL5265071

CC(C)(O)CC(=O)n1c(=O)[nH]c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
KMT2A Q03164 1/20 0.46
DAO P14920 1/20 0.46
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL5266608 0.80 DAO (0.50) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL7584888 0.78 MEN1 (0.47) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL6648995 0.78 MEN1 (0.47) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL5265643 0.77 DAO (0.50) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL14701887 0.76 DAO (0.56) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL11431122 0.76 DAO (0.60) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL7599845 0.75 DAO (0.47) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL2256797 0.75 DAO (0.47) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL444120 0.74 DAO (0.58) MEN1CYP1A2KMT2ADAOPOLB
SCHEMBL739582 0.74 CYP1A2 (0.63) MEN1CYP1A2KMT2ADAOPOLB

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
EP-1753731-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS Pharmacia Corporation (US) 2007-02-21 EP disclosed
EP-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP disclosed
WO-2004087677-A2 PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS PHARMACIA CORPORATION (US) 2004-10-14 WO disclosed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 WO disclosed