SCHEMBL13460809

SCHEMBL13460809

CC/C(C=O)=C\c1cccc(-c2ccc(OC)c(CNC(=O)c3ccc(C(F)(F)F)cc3F)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 19/20 0.58
▸ PPARA Q07869 15/20 0.58
▸ PPARG P37231 8/20 0.55
▸ PSEN1 P49768 1/20 0.49
▸ PSEN2 P49810 1/20 0.49
▸ APH1B Q8WW43 1/20 0.49
▸ NCSTN Q92542 1/20 0.49
▸ APH1A Q96BI3 1/20 0.49
▸ PSENEN Q9NZ42 1/20 0.49

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
SCHEMBL3411882 0.90 PSEN1 (0.62) PPARDPPARAPPARGPSEN1PSEN2
SCHEMBL3411876 0.90 PSEN1 (0.62) PPARDPPARAPPARGPSEN1PSEN2
SCHEMBL13460768 0.90 PPARD (0.61) PPARDPPARAPPARG
SCHEMBL13460807 0.87 PPARD (0.57) PPARDPPARAPPARG
SCHEMBL3416375 0.85 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL3416383 0.85 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL13460939 0.83 PPARD (0.66) PPARDPPARAPPARG
SCHEMBL13460782 0.82 PPARD (0.56) PPARDPPARAPPARG
SCHEMBL3415075 0.82 PPARD (0.79) PPARDPPARAPPARG
SCHEMBL13460798 0.82 PPARD (0.71) PPARDPPARAPPARG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
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