SCHEMBL6947408

SCHEMBL6947408

CCCCCOc1cc(CCCCCC[C@H](C(=O)O)C(C)C)ccc1OC

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 11/20 0.54
PPARG P37231 2/20 0.54
PPARA Q07869 1/20 0.54
SMPD1 P17405 1/20 0.48
PTGES O14684 1/20 0.48
ALOX5 P09917 1/20 0.48

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
SCHEMBL6947411 1.00 SIGMAR1 (0.54) SIGMAR1PPARGPPARASMPD1PTGES
SCHEMBL6942964 0.87 REN (0.44) SIGMAR1PPARGPPARA
SCHEMBL6942961 0.87 REN (0.44) SIGMAR1PPARGPPARA
SCHEMBL6940727 0.85 MTNR1A (0.54) SIGMAR1SMPD1
SCHEMBL6940732 0.85 MTNR1A (0.54) SIGMAR1SMPD1
SCHEMBL7076864 0.84 PPARA (0.42) SIGMAR1PPARGPPARA
SCHEMBL7076862 0.84 PPARA (0.42) SIGMAR1PPARGPPARA
SCHEMBL6940648 0.82 TUBB4A (0.54) PPARGPPARA
SCHEMBL6940652 0.82 TUBB4A (0.54) PPARGPPARA
SCHEMBL6941202 0.79 PPARA (0.45) SIGMAR1PPARGPPARA

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