SCHEMBL8917115

SCHEMBL8917115

CCCCCCCCCCCCCCCCOCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)OCCCCCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 9/20 0.56
PLA2G10 O15496 4/20 0.56
PLA2G1B P04054 3/20 0.56
PLA2G5 P39877 3/20 0.56
LPAR1 Q92633 4/20 0.46
LPAR3 Q9UBY5 4/20 0.46
LPAR2 Q9HBW0 1/20 0.46
TLR2 O60603 7/20 0.41

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
SCHEMBL497520 1.00 PLA2G2A (0.56) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL9137670 1.00 PLA2G2A (0.56) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL8979451 0.99 PLA2G2A (0.54) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL8357825 0.96 PLA2G2A (0.59) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL8974114 0.93 PLA2G2A (0.51) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL8004697 0.93 PLA2G2A (0.51) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL8004701 0.93 PLA2G2A (0.51) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL2233038 0.91 PLA2G2A (0.49) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL704578 0.91 PLA2G2A (0.52) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1
SCHEMBL2234605 0.91 PLA2G2A (0.49) PLA2G2APLA2G10PLA2G1BPLA2G5LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5645883-A Zwitterionic materials BIOCOMPATIBLES LIMITED (GB) 1997-07-08 US disclosed
EP-0681486-A1 NEW ZWITTERIONIC MATERIALS BIOCOMPATIBLES LIMITED (GB) 1995-11-15 EP disclosed
WO-1994016749-A1 NEW ZWITTERIONIC MATERIALS BIOCOMPATIBLES LIMITED (GB) 1994-08-04 WO disclosed