SCHEMBL6942964

SCHEMBL6942964

COCCOCCOc1cc(CCCCCCC(C(=O)O)C(C)C)ccc1OC

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.44
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
SIGMAR1 Q99720 4/20 0.43
PPARA Q07869 2/20 0.42
PPARD Q03181 1/20 0.42
PPARG P37231 1/20 0.41

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
SCHEMBL6942961 1.00 REN (0.44) RENPDE4APDE4BPDE4CPDE4D
SCHEMBL6947411 0.87 SIGMAR1 (0.54) SIGMAR1PPARAPPARG
SCHEMBL6947408 0.87 SIGMAR1 (0.54) SIGMAR1PPARAPPARG
SCHEMBL6940727 0.83 MTNR1A (0.54) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL6940732 0.83 MTNR1A (0.54) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL7076864 0.82 PPARA (0.42) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL7076862 0.82 PPARA (0.42) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL6941201 0.81 PPARA (0.45) RENPDE4APDE4BPDE4CPDE4D
SCHEMBL6941202 0.81 PPARA (0.45) RENPDE4APDE4BPDE4CPDE4D
SCHEMBL6940652 0.80 TUBB4A (0.54) PPARAPPARG

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-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed