SCHEMBL13767992

SCHEMBL13767992

CCOC(CC(COc1ccc(C)cc1)CSc1ccc(O)c(C)c1)OCC

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 19/20 0.43
PPARA Q07869 1/20 0.41
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL7018405 0.89 PPARD (0.57) PPARDPPARA
SCHEMBL10224791 0.87 PPARD (0.52) PPARDPPARA
SCHEMBL13680155 0.86 PPARD (0.54) PPARDPPARA
SCHEMBL13767993 0.84 PPARD (0.45) PPARDPPARA
SCHEMBL10226001 0.84 PPARD (0.56) PPARDPPARA
SCHEMBL13767911 0.84 PPARD (0.56) PPARDPPARA
SCHEMBL13680148 0.84 PPARD (0.47) PPARDPPARA
SCHEMBL13680159 0.84 PPARD (0.64) PPARDPPARA
SCHEMBL13768084 0.80 PPARD (0.44) PPARDPPARA
SCHEMBL13680157 0.79 PPARD (0.66) PPARDPPARA

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-1667964-B1 4-((PHENOXYALKYL)THIO)-PHENOXYACETIC ACIDS AND ANALOGS JANSSEN PHARMACEUTICA NV (BE) 2009-07-22 EP disclosed