SCHEMBL16771995

SCHEMBL16771995

N#CC(C#N)=c1cc/c(=C(/C#N)c2c(F)c(F)c(C#N)c(F)c2F)c(-c2ccc(F)c(C#N)c2)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
LRRK2 Q5S007 1/20 0.31
TRPV3 Q8NET8 1/20 0.30

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
SCHEMBL16771979 0.91 CYP11B2 (0.35)
SCHEMBL16772107 0.91 KDM1A (0.30)
SCHEMBL16772115 0.86
SCHEMBL16772092 0.86 KDM1A (0.31)
SCHEMBL16772100 0.86 ADORA2A (0.33)
SCHEMBL16772033 0.84 ADORA1 (0.33)
SCHEMBL16772122 0.84
SCHEMBL16772095 0.83 KDM4E (0.39)
SCHEMBL16771958 0.83 AR (0.33)
SCHEMBL16772007 0.82 ALDH1A1 (0.35)

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-20150155490-A1 ORGANIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed