SCHEMBL3433349

SCHEMBL3433349

CCOC(=O)Cc1ccc(OC)c(-c2ccc(C(F)(F)F)cc2)c1C(CC)NC(=O)NCc1ccccc1O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.37
PPARG P37231 9/20 0.37
PPARD Q03181 6/20 0.37
FPR2 P25090 2/20 0.36
EPHX2 P34913 4/20 0.35
ALDH1A1 P00352 1/20 0.35
PSEN1 P49768 2/20 0.34
PSEN2 P49810 2/20 0.34
APH1B Q8WW43 2/20 0.34
NCSTN Q92542 2/20 0.34
APH1A Q96BI3 2/20 0.34
PSENEN Q9NZ42 2/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL3433469 0.84 PPARA (0.40) PPARAPPARGPPARDEPHX2PSEN1
SCHEMBL3396254 0.82 PTGDR2 (0.45) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL3433346 0.78 PTGDR2 (0.45) PPARAPPARGPPARDEPHX2PTGDR2
SCHEMBL151169 0.78 PTGDR2 (0.49) PTGDR2
SCHEMBL3426982 0.76 PPARA (0.42) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL3433773 0.75 PPARA (0.43) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL15021253 0.74 ITGB1 (0.41) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL3397145 0.73 PPARA (0.39) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL136780 0.70 PTGDR2 (0.57) PTGDR2
SCHEMBL3411652 0.70 PPID (0.38) PPARAPPARGPPARDEPHX2ALDH1A1

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-2257524-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-12-08 EP disclosed
WO-2009099902-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed