SCHEMBL6544141

SCHEMBL6544141

CC(C)(Oc1ccc(CCCNCCCCc2nc3ccccc3o2)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.56
PPARG P37231 12/20 0.56
PPARD Q03181 3/20 0.56
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
ADRB3 P13945 3/20 0.47
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44

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
SCHEMBL6543066 0.99 PPARA (0.57) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL2438034 0.98 PPARA (0.58) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6543171 0.96 PPARA (0.56) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6543344 0.95 PPARA (0.57) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6544080 0.95 PPARA (0.57) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6542915 0.95 PPARA (0.57) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6544023 0.92 PPARA (0.54) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6544261 0.91 PPARA (0.55) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6544132 0.91 PPARA (0.54) PPARAPPARGPPARDKDM4EMAPT
SCHEMBL6543036 0.90 PPARA (0.57) PPARAPPARGPPARDKDM4EMAPT

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