SCHEMBL6504198

SCHEMBL6504198

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

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.71
PPARG P37231 8/20 0.71
PPARD Q03181 8/20 0.71
PSEN1 P49768 3/20 0.71
PSEN2 P49810 3/20 0.71
APH1B Q8WW43 3/20 0.71
NCSTN Q92542 3/20 0.71
APH1A Q96BI3 3/20 0.71
PSENEN Q9NZ42 3/20 0.71
EPHX2 P34913 1/20 0.55

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
SCHEMBL6375329 0.89 PPARA (0.82) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6376562 0.89 PPARA (0.80) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6376228 0.89 PPARA (0.70) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6505836 0.89 PPARA (0.81) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6497615 0.88 PPARA (0.84) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6377653 0.87 PPARA (0.83) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6505600 0.87 PPARA (0.72) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6495045 0.87 PPARA (0.72) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6381889 0.85 PPARA (0.76) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL6380273 0.84 PPARA (0.84) 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