SCHEMBL5384759

SCHEMBL5384759

C[N+](C)(C)CCOP(=O)([O-])OC(CO)COCCCCCCCCCCOCCCCc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PRKD3 O94806 1/20 0.43
PRKCG P05129 1/20 0.43
PRKCB P05771 1/20 0.43
PRKCA P17252 1/20 0.43
PRKCH P24723 1/20 0.43
AKT1 P31749 1/20 0.43
PRKCI P41743 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKCQ Q04759 1/20 0.43
PRKCZ Q05513 1/20 0.43
PRKCD Q05655 1/20 0.43
PRKD1 Q15139 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GMNN O75496 1/20 0.43
LMNA P02545 1/20 0.43
BLM P54132 1/20 0.43

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
SCHEMBL5371437 0.84 ADRA1D (0.49) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL14356218 0.81 ITPR1 (0.39) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL10799379 0.80 NR5A2 (0.47) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL14356217 0.78 FABP3 (0.40) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL29845243 0.77 NR5A2 (0.62) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL10702198 0.76 NR5A2 (0.68) ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL2734284 0.76 AKT1 (0.71) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL8643482 0.76 AKT1 (0.71) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL8007906 0.76 AKT1 (0.71) ALDH1A1MEN1KMT2APRKD3PRKCG
SCHEMBL8642035 0.76 AKT1 (0.71) ALDH1A1MEN1KMT2APRKD3PRKCG

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