SCHEMBL9486374

SCHEMBL9486374

CCCCCCCCOC(=O)C(C)P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 6/20 0.50
LPAR2 Q9HBW0 3/20 0.50
LPAR1 Q92633 2/20 0.50
NAAA Q02083 1/20 0.50
EPHX1 P07099 1/20 0.47
TSHR P16473 2/20 0.46
FDPS P14324 3/20 0.46
HCAR2 Q8TDS4 1/20 0.43
RAD52 P43351 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LAP3 P28838 1/20 0.43

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
SCHEMBL9486842 1.00 LPAR3 (0.50) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9485846 1.00 LPAR3 (0.50) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9486526 0.98 LPAR3 (0.48) LPAR3LPAR2LPAR1NAAAEPHX1
Diethylamine SCHEMBL27831363 0.92 EPHX1 (0.45) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9486529 0.82 NAAA (0.47) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9485911 0.82 NAAA (0.47) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9486342 0.82 NAAA (0.47) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL11224095 0.82 LPAR3 (0.47) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL9488560 0.80 LPAR3 (0.48) LPAR3LPAR2LPAR1NAAAEPHX1
SCHEMBL31544092 0.80 TSHR (0.61) LPAR3LPAR2TSHRHCAR2NPSR1

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-5260051-A Surfactants, soaps, toothpastes LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1993-11-09 US disclosed
EP-0493927-A1 Phosphate esters and compositions containing them UNILEVER PLC (GB) 1992-07-08 EP disclosed