SCHEMBL8050906

SCHEMBL8050906

CCCCCCCCOC(C)OP(=O)(O)OC(C)(OCCCC)OCCCC

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 7/20 0.39
LPAR1 Q92633 6/20 0.39
LPAR2 Q9HBW0 3/20 0.38
SMPD1 P17405 6/20 0.36
LPAR5 Q9H1C0 1/20 0.34

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
SCHEMBL28453080 0.96 LPAR3 (0.33) LPAR3LPAR1LPAR2SMPD1
SCHEMBL2523264 0.82 LPAR3 (0.50) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL2521045 0.82 LPAR3 (0.50) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL2520483 0.79 LPAR3 (0.40) LPAR3LPAR1LPAR2SMPD1
SCHEMBL18139522 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL18141137 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL11525690 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL2048392 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL18141043 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5
SCHEMBL18139846 0.76 LPAR3 (0.55) LPAR3LPAR1LPAR2SMPD1LPAR5

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
US-6030543-A A TRIALKOXYALKYL PHOSPHATE ESTER, A TRIALKYL PHOSPHATE OR A MIXTURE THEREOF, AND A TRIALKYL PHOSPHITE ESTER HAVING A POUR POINT OF LESS THAN-50.DEGREE. C.; EXTREME TEMPERATURE LUBRICANTS; WEAR, CORROSION AND HEAT RESISTANCES; RHEOLOGY GREAT LAKES CHEMICAL CORPORATION (US) 2000-02-29 US disclosed