SCHEMBL5265643

SCHEMBL5265643

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

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.50
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.42
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL11431122 0.79 DAO (0.60) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL7584888 0.78 MEN1 (0.47) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL6648995 0.78 MEN1 (0.47) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL444120 0.78 DAO (0.58) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL5265071 0.77 MEN1 (0.46) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL792991 0.76 DAO (0.56) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL7596452 0.76 DAO (0.56) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL2924922 0.76 DAO (0.56) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL11691177 0.76 DAO (0.56) DAOMEN1CYP1A2KMT2APOLB
SCHEMBL14701887 0.76 DAO (0.56) DAOMEN1CYP1A2KMT2APOLB

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