SCHEMBL5052012

SCHEMBL5052012

CCCCC/C=C\C/C=C\C(CCCCCCC(=O)OCC(C)O)CC(O)CO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.62
DGKA P23743 1/20 0.61
SELP P16109 1/20 0.55
MAPT P10636 1/20 0.52
PRKCE Q02156 1/20 0.51
PRKCQ Q04759 1/20 0.51
PRKCD Q05655 1/20 0.51
PRKCA P17252 1/20 0.51
LPAR1 Q92633 6/20 0.51
LPAR4 Q99677 3/20 0.51
LPAR2 Q9HBW0 3/20 0.51
LPAR3 Q9UBY5 3/20 0.51
ENPP2 Q13822 2/20 0.51
LPAR5 Q9H1C0 2/20 0.51
CES2 O00748 1/20 0.51
LPAR6 P43657 1/20 0.51
TRPV1 Q8NER1 1/20 0.51
KDM4E B2RXH2 1/20 0.50
DUSP3 P51452 1/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL2905900 0.89 MGLL (0.62) FAAHDGKASELPMAPTPRKCE
Glycerin SCHEMBL11207387 0.84 DGKA (0.82) FAAHDGKAMAPTPRKCEPRKCQ
Glycerin SCHEMBL11207390 0.84 DGKA (0.82) FAAHDGKAMAPTPRKCEPRKCQ
SCHEMBL1172881 0.84 MAPT (0.74) FAAHDGKAMAPTPRKCEPRKCQ
Glyceryl Monooleate SCHEMBL8340950 0.83 DGKA (0.90) FAAHDGKAMAPTPRKCEPRKCQ
SCHEMBL8702364 0.82 MAPT (0.71) FAAHDGKAMAPTPRKCEPRKCQ
SCHEMBL8702565 0.82 MAPT (0.71) FAAHDGKAMAPTPRKCEPRKCQ
Glyceryl Monolinoleate SCHEMBL154133 0.81 FAAH (0.92) FAAHDGKASELPPRKCEPRKCQ
Glyceryl Monolinoleate SCHEMBL19564919 0.81 FAAH (0.92) FAAHDGKASELPPRKCEPRKCQ
Glyceryl Monolinoleate SCHEMBL6371582 0.81 FAAH (0.92) FAAHDGKASELPPRKCEPRKCQ

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
US-20080279914-A1 Transdermal composition comprising piroxicam-inorganic material complex and patch system comprising the same SK HOLDINGS CO, LTD. (KR) 2008-11-13 US disclosed
CN-101032488-A Transdermal composition using piroxicam-inorganic complex and patch system comprising the same SK HOLDINGS CO LTD (KR) 2007-09-12 CN disclosed