SCHEMBL5378324

SCHEMBL5378324

O=C(OC(COCCCCCCCCCCOCCCCc1ccc2ccc3cccc4ccc1c2c34)COC(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PPARG P37231 1/20 0.34
GBA1 P04062 2/20 0.33
UGCG Q16739 2/20 0.33
GBA2 Q9HCG7 2/20 0.33
ITPR1 Q14643 1/20 0.31
MLNR O43193 1/20 0.30
NR1I2 O75469 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
HTR1A P08908 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
ADRB3 P13945 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2C P18825 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2A P28223 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL5379967 0.87 MEN1 (0.47) MEN1KMT2APPARGGBA1UGCG
SCHEMBL14356213 0.86 KMT2A (0.37) MEN1KMT2A
SCHEMBL5384418 0.83 MEN1 (0.44) MEN1KMT2AGBA1UGCGGBA2
SCHEMBL10769223 0.82 KMT2A (0.44) MEN1KMT2AGBA1UGCGGBA2
SCHEMBL8663631 0.82 PLA2G2A (0.43) MEN1KMT2AGBA1UGCGGBA2
SCHEMBL14356217 0.79 FABP3 (0.40) MEN1KMT2AITPR1
SCHEMBL10598820 0.79 MEN1 (0.48) MEN1KMT2A
SCHEMBL5371437 0.78 ADRA1D (0.49) MEN1KMT2A
SCHEMBL6047160 0.75 MEN1 (0.39) MEN1KMT2AGBA1UGCGGBA2
SCHEMBL14356214 0.73 KMT2A (0.41) MEN1KMT2APPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7301043-B2 Compounds for determining the activity of phospholipase A2 SIRS-LAB GMBH (DE) 2007-11-27 US disclosed
US-20050064532-A1 Platelet-Activating Factor Acetylhydrolase; for diagnosis of various conditions; eg 1-O-{(10-[4-(pyrene-1-yl)-butoxy]-decyl}-2-(6-(2,4-dinitrophenyl)-aminohexoyl)-rac-glycero-3-phosphocholine SIRS-LAB GMBH (DE) 2005-03-24 US disclosed
EP-1318154-B1 Compounds for determination of the activity of phospholipase A2 SIRS LAB GMBH (DE) 2004-06-16 EP disclosed
WO-2003048172-A1 COMPOUNDS FOR DETERMINING THE ACTIVITY OF PHOSPHOLIPASE A¿2? SIRS-LAB GMBH (DE) 2003-06-12 WO disclosed
EP-1318154-A1 Compounds for determination of the activity of phospholipase A2 SIRS-Lab GmbH (DE) 2003-06-11 EP disclosed