SCHEMBL9486359

SCHEMBL9486359

CCCCCCCCCCCCOC(=O)CC(C)P(=O)(O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
NPSR1 Q6W5P4 2/20 0.47
RAD52 P43351 1/20 0.47
FAAH O00519 1/20 0.46
LPAR3 Q9UBY5 3/20 0.46
LPAR1 Q92633 2/20 0.46
LPAR2 Q9HBW0 2/20 0.46
DGKA P23743 1/20 0.46
HTR2C P28335 1/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX1 P07099 1/20 0.43
TSHR P16473 2/20 0.42
P2RY10 O00398 1/20 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
SCHEMBL9485768 1.00 NAAA (0.55) NAAANPSR1RAD52FAAHLPAR3
SCHEMBL9487184 0.84 NAAA (0.51) NAAANPSR1RAD52FAAHLPAR3
SCHEMBL9487811 0.84 NAAA (0.51) NAAANPSR1RAD52FAAHLPAR3
SCHEMBL4316279 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL872735 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL17891959 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL17891961 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL3504225 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL17891951 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA
SCHEMBL27919918 0.80 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA

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