SCHEMBL4409245

SCHEMBL4409245

Cc1cc(SC[C@@H](O)COc2ccc(C(F)(F)F)cc2)ccc1O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.70
PPARA Q07869 1/20 0.52

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
SCHEMBL4407317 1.00 PPARD (0.70) PPARDPPARA
SCHEMBL7018228 1.00 PPARD (0.70) PPARDPPARA
SCHEMBL7017934 0.89 PPARD (0.70) PPARDPPARA
SCHEMBL7020176 0.88 PPARD (0.70) PPARDPPARA
SCHEMBL7015236 0.87 PPARD (0.76) PPARDPPARA
SCHEMBL377674 0.87 PPARD (0.72) PPARDPPARA
SCHEMBL7015833 0.87 PPARD (0.76) PPARDPPARA
SCHEMBL377314 0.87 PPARD (0.72) PPARDPPARA
SCHEMBL13768082 0.87 PPARD (0.53) PPARD
SCHEMBL7021445 0.86 PPARD (0.71) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635718-B2 4-((phenoxyalkyl)thio)-phenoxyacetic acids and analogs JANSSEN PHARMACEUTICA NV (BE) 2009-12-22 US claimed
EP-1667964-B1 4-((PHENOXYALKYL)THIO)-PHENOXYACETIC ACIDS AND ANALOGS JANSSEN PHARMACEUTICA NV (BE) 2009-07-22 EP disclosed