SCHEMBL6497615

SCHEMBL6497615

CCOC(=O)C(Cc1ccc(OC)c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1)OCC

nearest known ligand 0.84

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.84
PPARG P37231 8/20 0.84
PPARD Q03181 8/20 0.84
PSEN1 P49768 3/20 0.68
PSEN2 P49810 3/20 0.68
APH1B Q8WW43 3/20 0.68
NCSTN Q92542 3/20 0.68
APH1A Q96BI3 3/20 0.68
PSENEN Q9NZ42 3/20 0.68
EPHX2 P34913 1/20 0.53

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
SCHEMBL6376562 0.93 PPARA (0.80) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6494122 0.91 PPARA (1.00) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6505600 0.91 PPARA (0.72) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6495045 0.91 PPARA (0.72) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6504198 0.88 PPARA (0.71) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6493880 0.88 PPARA (0.73) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6503575 0.87 PPARA (0.74) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6376228 0.87 PPARA (0.70) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6375329 0.87 PPARA (0.82) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6496735 0.86 PPARA (0.71) PPARAPPARGPPARDPSEN1PSEN2

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
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed