SCHEMBL6821028

SCHEMBL6821028

CCOC(=O)C(Cc1ccc(OCCc2ccc(Sc3ccccc3)cc2)cc1)Sc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.47
PPARA Q07869 10/20 0.47
ALOX5 P09917 8/20 0.47
FFAR1 O14842 1/20 0.47
PTGES O14684 5/20 0.46
TDP1 Q9NUW8 1/20 0.43
PPARD Q03181 1/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 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
SCHEMBL5991960 0.89 PPARA (0.45) PPARGPPARAALOX5FFAR1PTGES
SCHEMBL6821601 0.88 PPARG (0.48) PPARGPPARAALOX5FFAR1PTGES
SCHEMBL7243191 0.88 PPARG (0.52) PPARGPPARAALOX5FFAR1PTGES
SCHEMBL5992824 0.85 PPARA (0.56) PPARGPPARAFFAR1PPARD
SCHEMBL5992817 0.85 PPARA (0.56) PPARGPPARAFFAR1PPARD
SCHEMBL5991287 0.80 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL5991298 0.80 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL5991810 0.80 PPARG (0.55) PPARGPPARAALOX5FFAR1PTGES
SCHEMBL5992000 0.79 PPARG (0.50) PPARGPPARAALOX5FFAR1PTGES
SCHEMBL5992755 0.79 MMP8 (0.45) PPARGLMNAL3MBTL1ALDH1A1

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-1237857-B1 NEW PHENALKYLOXY-PHENYL DERIVATIVES ASTRAZENECA AB (SE) 2004-06-30 EP disclosed