SCHEMBL4621536

SCHEMBL4621536

CCCCc1ccc(OC(N)=O)c(CCCC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.44
HTT P42858 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
APAF1 O14727 1/20 0.43
THRB P10828 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SKP2 Q13309 1/20 0.41
LTA4H P09960 1/20 0.40

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
SCHEMBL1022843 0.94 PPARA (0.50) HTTMAPTMAPK1APAF1THRB
SCHEMBL20503291 0.85 SKP2 (0.53) HTTMAPTMAPK1L3MBTL1PPARG
SCHEMBL27859116 0.85 THRA (0.42) HTTMAPTTHRBPPARGPPARA
SCHEMBL11669011 0.85 AKT1 (0.47) AKT1HTTMAPTMAPK1APAF1
SCHEMBL3417619 0.85 AKT1 (0.44) AKT1HTTMAPTMAPK1APAF1
SCHEMBL8758579 0.83 CYP2D6 (0.43) PPARGPPARA
SCHEMBL11668709 0.81 PPARG (0.49) HTTMAPTMAPK1APAF1THRB
SCHEMBL11668856 0.81 MAPT (0.48) AKT1HTTMAPTMAPK1APAF1
SCHEMBL11669013 0.80 RARB (0.56) AKT1HTTMAPTMAPK1APAF1
SCHEMBL874719 0.80 AKT1 (0.43) AKT1HTTMAPTMAPK1APAF1

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-1897416-A1 ELECTROLUMINESCENT DEVICES WITH NITROGEN BIDENTATE LIGANDS EASTMAN KODAK COMPANY (US) 2008-03-12 EP disclosed
EP-1883982-A2 OLED ELECTRON-TRANSPORTING LAYER EASTMAN KODAK COMPANY (US) 2008-02-06 EP disclosed
WO-2007005252-A1 ELECTROLUMINESCENT DEVICES WITH NITROGEN BIDENTATE LIGANDS EASTMAN KODAK COMPANY (US) 2007-01-11 WO disclosed
WO-2006127315-A2 OLED-ELECTRON TRANSPORTING LAYER EASTMAN KODAK COMPANY (US) 2006-11-30 WO disclosed