SCHEMBL7813151

SCHEMBL7813151

CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)C(=O)OP(=O)(O)O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 6/20 0.52
LPAR3 Q9UBY5 6/20 0.52
CETP P11597 3/20 0.49
LPAR2 Q9HBW0 1/20 0.44
LPAR5 Q9H1C0 1/20 0.42
TLR2 O60603 4/20 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
SCHEMBL25335565 0.88 LPAR1 (0.67) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL31069863 0.88 LPAR1 (0.67) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL385051 0.88 LPAR1 (0.67) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL10929587 0.86 LPAR1 (0.64) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL4481628 0.85 CETP (0.49) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL4483073 0.85 CETP (0.50) LPAR1LPAR3CETPLPAR2TLR2
SCHEMBL29014838 0.84 LPAR1 (0.59) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL88391 0.83 LPAR3 (0.70) LPAR1LPAR3LPAR2LPAR5TLR2
SCHEMBL30931378 0.83 LPAR1 (0.53) LPAR1LPAR3CETPLPAR2LPAR5
SCHEMBL8736629 0.82 LPAR1 (0.52) LPAR1LPAR3CETPLPAR2LPAR5

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
EP-0674646-B1 LIPID DERIVATIVES OF PHOSPHONOACIDS FOR LIPOSOMAL INCORPORATION AND METHOD OF USE CHIMERIX INC (US) 2001-10-04 EP disclosed
US-5463092-A Viricides VESTAR, INC. (US) 1995-10-31 US disclosed