SCHEMBL13767993

SCHEMBL13767993

CCCC(COc1ccc(C)cc1)CSc1ccc(O)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.45
PPARA Q07869 2/20 0.38
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
PPARG P37231 1/20 0.37
ESR1 P03372 2/20 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
SCHEMBL10224791 0.91 PPARD (0.52) PPARDPPARA
SCHEMBL13680155 0.90 PPARD (0.54) PPARDPPARA
SCHEMBL13768084 0.88 PPARD (0.44) PPARDPPARAPTGESALOX5PPARG
SCHEMBL13680148 0.88 PPARD (0.47) PPARDPPARA
SCHEMBL7017719 0.88 PPARD (0.61) PPARDPPARA
SCHEMBL13767992 0.84 PPARD (0.43) PPARDPPARA
SCHEMBL13680157 0.83 PPARD (0.66) PPARDPPARA
SCHEMBL13768082 0.83 PPARD (0.53) PPARD
SCHEMBL13767911 0.81 PPARD (0.56) PPARDPPARA
SCHEMBL10226001 0.81 PPARD (0.56) 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