SCHEMBL9657809

SCHEMBL9657809

CCCCCCOC(=O)C1CC2OC2CC1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.46
EPHX1 P07099 1/20 0.44
FAAH O00519 1/20 0.43
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
TSHR P16473 3/20 0.40
PPM1B O75688 1/20 0.40
PTPN1 P18031 1/20 0.40
PPP1CC P36873 1/20 0.40
EPHX2 P34913 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ACHE P22303 2/20 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
SCHEMBL14394363 1.00 NAAA (0.46) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL13935401 1.00 NAAA (0.46) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9656347 0.94 NAAA (0.52) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL123577 0.94 NAAA (0.52) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9655845 0.94 NAAA (0.52) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9188266 0.94 NAAA (0.52) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9656983 0.89 PPM1B (0.50) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9656931 0.88 PPM1B (0.47) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL16415728 0.88 PPM1B (0.47) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL9656900 0.87 PPM1B (0.46) NAAACHRM2CHRM4CHRM5CHRM1

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
EP-0479166-A1 Transesterification process for preparation of cycloaliphatic epoxides UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-08 EP disclosed