SCHEMBL8567703

SCHEMBL8567703

COC(COP(=O)(O)O)(OC)OC

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 7/20 0.37
LPAR2 Q9HBW0 5/20 0.37
LPAR1 Q92633 4/20 0.37
FBP1 P09467 1/20 0.35
TPI1 P60174 2/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
S1PR2 O95136 1/20 0.30
S1PR4 O95977 1/20 0.30
S1PR5 Q9H228 1/20 0.30

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
SCHEMBL31194761 0.76 LPAR3 (0.43) LPAR3LPAR2LPAR1TPI1PGK1
SCHEMBL8899260 0.76 LPAR3 (0.39) LPAR3LPAR2LPAR1FBP1S1PR1
SCHEMBL29029234 0.75 GAA (0.35) LPAR3LPAR2LPAR1FBP1TPI1
SCHEMBL2470417 0.74 LPAR3 (0.39) LPAR3LPAR2LPAR1FBP1TPI1
SCHEMBL5974079 0.74 LPAR3 (0.39) LPAR3LPAR2LPAR1FBP1TPI1
SCHEMBL15725546 0.73 FBP1 (0.41) LPAR3LPAR2LPAR1FBP1TPI1
SCHEMBL6413988 0.72 LPAR3 (0.43) LPAR3LPAR2LPAR1FBP1TPI1
Ammonia Solution, Strong SCHEMBL27519730 0.72 LPAR3 (0.38) LPAR3LPAR2LPAR1FBP1TPI1
Phosphoric Acid SCHEMBL17477137 0.72 LPAR3 (0.38) LPAR3LPAR2LPAR1FBP1TPI1
SCHEMBL8900249 0.71 SMPD1 (0.34)

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
JP-10228928-A None JP disclosed
JP-H10228928-A FIRE RESISTANT ELECTROLYTE DENSO CORP 1998-08-25 JP disclosed
US-5623069-A PHOSPHORYLATION OF NUCLEOSIDE IN AN ORGANIC PHOSPHATE SOLVENT USING PHOSPHORUS OXYHALOGENIDE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-22 US disclosed