SCHEMBL377879

SCHEMBL377879

CC[C@H](COc1ccc(OC(F)(F)F)cc1)CSc1ccc([O])c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.57
PPARA Q07869 1/20 0.42

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
SCHEMBL27665247 0.87 PPARD (0.57) PPARDPPARA
SCHEMBL377880 0.87 PPARD (0.57) PPARDPPARA
SCHEMBL377611 0.83 PPARD (0.62) PPARDPPARA
SCHEMBL377553 0.83 PPARD (0.82) PPARDPPARA
SCHEMBL377554 0.83 PPARD (0.82) PPARDPPARA
SCHEMBL377610 0.83 PPARD (0.62) PPARDPPARA
SCHEMBL3441400 0.83 PPARD (0.64) PPARDPPARA
SCHEMBL7015154 0.76 PPARD (0.74) PPARDPPARA
SCHEMBL7021445 0.76 PPARD (0.71) PPARDPPARA
SCHEMBL7015399 0.76 PPARD (0.74) 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-2100877-B1 4-((Phenoxyalkyl)thio)-phenoxyacetic acids and analogs JANSSEN PHARMACEUTICA NV (BE) 2012-01-25 EP claimed