SCHEMBL13069630

SCHEMBL13069630

CC(C)(Oc1cccc(Oc2ccc3c(-c4cc#cc(C(F)(F)F)c4)noc3c2)c1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 18/20 0.42
▸ PPARD Q03181 17/20 0.42
▸ PPARG P37231 17/20 0.42
▸ LMNA P02545 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ BLM P54132 1/20 0.34

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
SCHEMBL3376896 0.84 PPARD (0.53) PPARAPPARDPPARG
SCHEMBL3375295 0.83 PPARA (0.47) PPARAPPARDPPARG
SCHEMBL3377036 0.83 PPARG (0.47) PPARAPPARDPPARGCYP2C9TSHR
SCHEMBL13069647 0.81 PPARG (0.46) PPARAPPARDPPARGCYP2C9TSHR
SCHEMBL3378784 0.80 PPARA (0.47) PPARAPPARDPPARG
SCHEMBL3379784 0.78 PPARD (0.46) PPARAPPARDPPARGCYP2C9TSHR
SCHEMBL3376214 0.78 PPARG (0.51) PPARAPPARDPPARG
SCHEMBL3410208 0.78 PPARA (0.48) PPARAPPARDPPARG
SCHEMBL3376815 0.77 PPARA (0.53) PPARAPPARDPPARG
SCHEMBL13069652 0.76 PPARA (0.48) PPARAPPARDPPARGCYP2C9

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-1796665-B1 COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK SHARP & DOHME (US) 2010-11-17 — — EP disclosed
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