SCHEMBL14355016

SCHEMBL14355016

Cc1cc(SCC/C=C/c2ccc(C(F)(F)F)cc2)ccc1OCCOO

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.44
PPARA Q07869 1/20 0.41

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
SCHEMBL7016447 0.89 PPARD (0.45) PPARDPPARA
SCHEMBL7015185 0.85 PPARD (0.41) PPARDPPARA
SCHEMBL377267 0.85 PPARD (0.63) PPARDPPARA
SCHEMBL377268 0.85 PPARD (0.63) PPARDPPARA
SCHEMBL10151835 0.84 PPARD (0.51) PPARDPPARA
SCHEMBL14355030 0.82 PPARD (0.48) PPARDPPARA
SCHEMBL7021219 0.82 PPARD (0.40) PPARDPPARA
SCHEMBL14355071 0.80 PPARD (0.53) PPARDPPARA
SCHEMBL14355021 0.79 PPARD (0.49) PPARDPPARA
SCHEMBL14355012 0.74 PPARD (0.73) 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
US-7301050-B2 4-((phenoxyalkyl)thio)-phenoxyacetic acids and analogs JANSSEN PHARMACEUTICAL N.V. (BE) 2007-11-27 US disclosed