SCHEMBL27516633

SCHEMBL27516633

O=CC(Cc1ccc(F)cc1)c1cccc(F)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
SLC6A9 P48067 1/20 0.38
SLC6A5 Q9Y345 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
NFE2L2 Q16236 1/20 0.36
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
CNR1 P21554 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
SCHEMBL28867116 0.85 EPHX1 (0.42) CNR2PPARGPPARA
SCHEMBL9108230 0.84 CTSB (0.36) CNR2HDAC4HDAC7HDAC5
SCHEMBL28805788 0.83 OPRM1 (0.39) CNR2HDAC4HDAC7HDAC5CES2
SCHEMBL27608063 0.81 NFE2L2 (0.43) CNR2NFE2L2CNR1
SCHEMBL27586696 0.78 HDAC4 (0.41) CNR2HDAC4HDAC7HDAC5SLC6A9
SCHEMBL30435064 0.78 HDAC4 (0.45) CNR2HDAC4HDAC7HDAC5SLC6A9
SCHEMBL25772213 0.78 HDAC4 (0.45) CNR2HDAC4HDAC7HDAC5SLC6A9
SCHEMBL27695773 0.77 LOXL2 (0.37) MAOAMAOB
SCHEMBL27907592 0.75 HDAC4 (0.39) CNR2HDAC4HDAC7HDAC5CES2
SCHEMBL27516632 0.75 HDAC4 (0.46) CNR2HDAC4HDAC7HDAC5SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1951939-A Novel pyrrole derivatives as pharmaceutical agents LILLY CO ELI (US) 2007-04-25 CN disclosed
CN-1269820-C Novel pyrrole derivatives as medicaments LILLY CO ELI (US) 2006-08-16 CN disclosed
CN-1511157-A Novel pyrrole derivatives as medicaments 2004-07-07 CN disclosed