SCHEMBL9798355

SCHEMBL9798355

CCCCCCCCCCCCCCCCOCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)Oc1ccon1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 11/20 0.46
PLA2G10 O15496 4/20 0.46
PLA2G1B P04054 3/20 0.46
PLA2G5 P39877 3/20 0.46
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
HTT P42858 1/20 0.32
ABCB1 P08183 1/20 0.31
LPAR6 P43657 3/20 0.31
LPAR1 Q92633 3/20 0.31
LPAR4 Q99677 3/20 0.31
LPAR5 Q9H1C0 3/20 0.31
LPAR2 Q9HBW0 3/20 0.31
LPAR3 Q9UBY5 3/20 0.31

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
SCHEMBL9798948 1.00 PLA2G2A (0.46) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL9798365 1.00 PLA2G2A (0.46) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL9799022 1.00 PLA2G2A (0.46) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL9670952 0.84 PLA2G2A (0.40) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL9528937 0.82 PLA2G2A (0.34) PLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL9528946 0.82 PLA2G2A (0.34) PLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL9531777 0.81 PLA2G2A (0.39) PLA2G2APLA2G10PLA2G1BPLA2G5FAAH
SCHEMBL9799057 0.81 PLA2G2A (0.47) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL9799059 0.81 PLA2G2A (0.47) PLA2G2APLA2G10PLA2G1BPLA2G5CYP1A2
SCHEMBL2233937 0.80 PLA2G2A (0.47) PLA2G2APLA2G10PLA2G1BPLA2G5HTT

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-5068340-A Antagonist of platelet activating factor for treatment of asthma, inflammation or shock SANKYO COMPANY, LIMITED (JP) 1991-11-26 US disclosed
EP-0238202-A2 Glycerol derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1987-09-23 EP disclosed