SCHEMBL6688620

SCHEMBL6688620

CCCCCCCCCCP(=O)(O)OP(C)(=O)OP(=O)(O)CCCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.56
LPAR2 Q9HBW0 3/20 0.56
CETP P11597 5/20 0.49
LPAR1 Q92633 2/20 0.45
FAAH O00519 1/20 0.44
TRPM8 Q7Z2W7 4/20 0.42

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
SCHEMBL5701288 1.00 LPAR3 (0.56) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL8573803 0.89 LPAR3 (0.62) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL7131054 0.89 LPAR3 (0.62) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL2217506 0.89 LPAR3 (0.62) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL22722949 0.89 LPAR3 (0.62) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL8568172 0.89 LPAR3 (0.62) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL5701289 0.88 LPAR3 (0.56) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL6688623 0.88 LPAR3 (0.56) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL11319867 0.87 LPAR3 (0.58) LPAR3LPAR2CETPLPAR1FAAH
SCHEMBL5701186 0.86 LPAR3 (0.54) LPAR3LPAR2CETPLPAR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004085448-A2 UNSATURATED PHOSPHINYL-PHOSPHONATE PHOSPHATE TRANSPORT INHIBITORS GENZYME CORPORATION (US) 2004-10-07 WO disclosed