SCHEMBL9723686

SCHEMBL9723686

CCCCCCCCCCCCCC(=O)C(O)(C(=O)OCCCCCCCCCC)C(O)(C(=O)CCCCCCCCCCCCC)C(=O)OCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.48
CES1 P23141 5/20 0.48
CES2 O00748 2/20 0.48
NAAA Q02083 1/20 0.48
DGKA P23743 1/20 0.48
MEN1 O00255 1/20 0.48
CYP1A2 P05177 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
EPHX1 P07099 1/20 0.46
DNM1 Q05193 1/20 0.45
TSHR P16473 2/20 0.44
HTR2C P28335 1/20 0.44

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
SCHEMBL19837283 0.87 FAAH (0.50) FAAHCES1CES2DGKAMEN1
SCHEMBL5530059 0.81 FAAH (0.44) FAAHCES1CES2NAAADGKA
SCHEMBL28211894 0.79 FAAH (0.46) FAAHCES1CES2NAAADGKA
SCHEMBL7786543 0.79 FAAH (0.46) FAAHCES1CES2NAAADGKA
SCHEMBL9723691 0.79 NAAA (0.50) FAAHCES1CES2NAAADGKA
SCHEMBL19837284 0.79 FAAH (0.48) FAAHCES1CES2MEN1CYP1A2
SCHEMBL9487820 0.77 NAAA (0.55) FAAHNAAADGKAEPHX1TSHR
SCHEMBL1548335 0.77 NAAA (0.55) FAAHNAAADGKAEPHX1TSHR
SCHEMBL27562251 0.77 FAAH (0.43) FAAHCES1CES2NAAADGKA
SCHEMBL2477982 0.75 NAAA (0.57) FAAHNAAADGKAEPHX1TSHR

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
WO-1992001386-A1 REDUCED CALORIE CONFECTIONERY COMPOSITIONS NABISCO, INC. (US) 1992-02-06 WO disclosed