SCHEMBL6544104

SCHEMBL6544104

CC(C)(Oc1ccccc1CN(Cc1cccc2ccccc12)c1nc2ccccc2o1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.54
PPARG P37231 16/20 0.54
PPARD Q03181 14/20 0.54
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL6543017 0.93 PPARA (0.55) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL6543006 0.92 PPARA (0.56) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL2434140 0.88 PPARA (0.61) PPARAPPARGPPARDCYP2C9CYP2C19
SCHEMBL2435946 0.86 PPARA (0.73) PPARAPPARGPPARD
SCHEMBL6542927 0.86 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL6542969 0.85 PPARA (0.56) PPARAPPARGPPARD
SCHEMBL6543018 0.85 PPARA (0.49) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL6542809 0.85 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL6543464 0.84 PPARA (0.48) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL14583412 0.84 PPARA (0.73) PPARAPPARGPPARD

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
EP-1433786-A1 Benzoxazole compound and pharmaceutical composition containing the compound Kowa Company Ltd. (JP) 2004-06-30 EP disclosed
US-6653334-B1 Electively activate peroxisome proliferator activated receptors KOWA CO., LTD. (JP) 2003-11-25 US disclosed