SCHEMBL6164763

SCHEMBL6164763

Cc1cc(SCc2cc(-c3ccc(C(F)(F)F)cc3)oc2CN(C)C2CCCCC2)ccc1OCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.59
PPARA Q07869 6/20 0.59
PPARG P37231 2/20 0.57

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
Hydrochloric Acid SCHEMBL5862770 0.99 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL6164377 0.86 PPARD (0.41) PPARDPPARAPPARG
SCHEMBL6164370 0.86 PPARD (0.41) PPARDPPARAPPARG
SCHEMBL5860987 0.86 PPARD (0.61) PPARDPPARAPPARG
SCHEMBL5860678 0.85 PPARD (0.60) PPARDPPARAPPARG
SCHEMBL5862001 0.84 PPARD (0.64) PPARDPPARAPPARG
SCHEMBL5860573 0.83 PPARD (0.68) PPARDPPARAPPARG
SCHEMBL5861936 0.83 PPARD (0.69) PPARDPPARAPPARG
SCHEMBL5862784 0.83 PPARD (0.69) PPARDPPARAPPARG
SCHEMBL6166880 0.82 PPARD (0.57) PPARDPPARAPPARG

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-1392674-B1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS SMITHKLINE BEECHAM CORP (US) 2005-08-10 EP disclosed