SCHEMBL6543404

SCHEMBL6543404

CC(C)(Oc1cccc(CCCNCCCCc2nc3ccccc3o2)c1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.60
PPARA Q07869 10/20 0.60
PPARD Q03181 5/20 0.60
MTNR1A P48039 4/20 0.44
MTNR1B P49286 4/20 0.44
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 1/20 0.41
TP53 P04637 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
SCHEMBL6543021 0.99 PPARG (0.59) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6544252 0.98 PPARG (0.62) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6543898 0.96 PPARG (0.58) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6543114 0.95 PPARG (0.57) PPARGPPARAPPARDCYP4F2CYP4A11
SCHEMBL6544098 0.95 PPARG (0.61) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6544109 0.95 PPARG (0.59) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6542943 0.93 PPARA (0.56) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6544090 0.92 PPARG (0.55) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6542939 0.92 PPARG (0.56) PPARGPPARAPPARDMTNR1AMTNR1B
SCHEMBL6543077 0.91 PPARG (0.60) PPARGPPARAPPARDMAPT

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