SCHEMBL6941202

SCHEMBL6941202

COCCCOc1cc(CCCCCCC(C)C(=O)O)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.45
PPARG P37231 1/20 0.45
LDHA P00338 1/20 0.45
PDE4A P27815 3/20 0.45
PDE4B Q07343 3/20 0.45
PDE4C Q08493 3/20 0.45
PDE4D Q08499 3/20 0.45
REN P00797 8/20 0.44
SIGMAR1 Q99720 2/20 0.44
PPARD Q03181 1/20 0.43

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
SCHEMBL6941201 1.00 PPARA (0.45) PPARAPPARGLDHAPDE4APDE4B
SCHEMBL6948739 0.88 MTNR1A (0.50) PPARGREN
SCHEMBL6948737 0.88 MTNR1A (0.50) PPARGREN
SCHEMBL6943609 0.83 PPARA (0.56) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL17768390 0.82 REN (0.49) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL14538389 0.82 PPARA (0.57) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL6942961 0.81 REN (0.44) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL6942964 0.81 REN (0.44) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL6943259 0.81 REN (0.43) PPARAPPARGPDE4APDE4BPDE4C
SCHEMBL27930278 0.80 STAT3 (0.45) LDHARENSIGMAR1

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