SCHEMBL5963725

SCHEMBL5963725

CC(CCOP(=O)(O)O)OP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 10/20 0.42
LPAR2 Q9HBW0 6/20 0.42
LPAR1 Q92633 6/20 0.42
SMPD1 P17405 3/20 0.38
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
METAP1 P53582 1/20 0.32

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
SCHEMBL5963400 0.88 LPAR3 (0.48) LPAR3LPAR2LPAR1SMPD1LPAR5
SCHEMBL5963355 0.86 LPAR3 (0.52) LPAR3LPAR2LPAR1SMPD1LPAR5
SCHEMBL5964227 0.84 LPAR3 (0.55) LPAR3LPAR2LPAR1SMPD1LPAR5
SCHEMBL9230529 0.81 LPAR3 (0.41) LPAR3LPAR2LPAR1PGK1PGK2
SCHEMBL1270333 0.79 LPAR3 (0.46) LPAR3LPAR2LPAR1PGK1PGK2
SCHEMBL5963439 0.79 LPAR3 (0.39) LPAR3LPAR2LPAR1SMPD1PGK1
SCHEMBL2048486 0.77 LPAR3 (0.45) LPAR3LPAR2LPAR1PGK1PGK2
SCHEMBL28933243 0.77 LPAR3 (0.45) LPAR3LPAR2LPAR1PGK1PGK2
Methane SCHEMBL7755990 0.77 LPAR3 (0.45) LPAR3LPAR2LPAR1PGK1PGK2
SCHEMBL31506206 0.77 LPAR3 (0.45) LPAR3LPAR2LPAR1PGK1PGK2

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-20060172201-A1 Non-aqueous electrolyte and lithium secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2006-08-03 US disclosed
EP-1357628-A1 NONAQUEOUS ELECTROLYTIC LIQUIDS AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-10-29 EP disclosed