SCHEMBL5520732

SCHEMBL5520732

CCCCCCCCCCCCCCCCCCOC(=O)C1CCC(C)CC1C(=O)OCCCCCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
TSHR P16473 3/20 0.42
CES2 O00748 1/20 0.41
PPARG P37231 3/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
FAAH O00519 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL5521653 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL1195415 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL5520465 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL5524052 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL1196010 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL5517500 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL1196017 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL5526534 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL5520367 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2
SCHEMBL1195968 1.00 NAAA (0.46) NAAARAD52NPSR1EPHX1CHRM2

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-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
EP-1227078-A1 DICARBOXYLIC DIESTER, PROCESS FOR PRODUCING THE SAME, AND REFRIGERATING MACHINE LUBRICATING OIL COMPRISING THE ESTER NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-31 EP disclosed