SCHEMBL5155162

SCHEMBL5155162

O=C(O)OC1CN(C(=O)Cc2cc(C(=O)O)ccc2OCCCc2ccc(OCCCCOC3CCCCC3)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.54
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.35
PDE4B Q07343 3/20 0.35
PDE4A P27815 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
DNMT3A Q9Y6K1 1/20 0.35
PLA2G4B P0C869 1/20 0.35
PLA2G2D Q9UNK4 1/20 0.35
NR1H4 Q96RI1 1/20 0.34
PPARG P37231 2/20 0.34
PPARA Q07869 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL5152416 0.94 CYSLTR2 (0.52) CYSLTR2MEN1KMT2AMAPTPDE4B
SCHEMBL5125683 0.92 CYSLTR2 (0.61) CYSLTR2MEN1KMT2AMAPTPLA2G4B
SCHEMBL5110467 0.87 CYSLTR2 (0.60) CYSLTR2MEN1KMT2AHRH3
SCHEMBL14131825 0.87 CYSLTR2 (0.60) CYSLTR2MEN1KMT2AHRH3
SCHEMBL14145205 0.86 CYSLTR2 (0.61) CYSLTR2MEN1KMT2AMAPTPLA2G4B
SCHEMBL5155332 0.84 CYSLTR2 (0.45) CYSLTR2PPARGPPARAHRH3
SCHEMBL5155579 0.84 CYSLTR2 (0.44) CYSLTR2MEN1KMT2APLA2G2DHRH3
SCHEMBL5118730 0.81 CYSLTR2 (0.48) CYSLTR2MEN1KMT2AHRH3
SCHEMBL5118877 0.81 CYSLTR2 (0.58) CYSLTR2MEN1KMT2AMAPTPDE4B
SCHEMBL5174823 0.81 CYSLTR2 (0.43) CYSLTR2MEN1KMT2AMAPTHRH3

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-1740540-A1 PHENYL ACETAMIDES Bayer HealthCare AG (DE) 2007-01-10 EP disclosed
WO-2005103001-A1 PHENYL ACETAMIDES BAYER HEALTHCARE AG (DE) 2005-11-03 WO disclosed