SCHEMBL1982974

SCHEMBL1982974

CCc1c[c]ccc1-c1cccc(C#N)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.50
PGR P06401 3/20 0.41
USP7 Q93009 2/20 0.41
CLK4 Q9HAZ1 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40
BRD4 O60885 1/20 0.40
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRA3 P34903 2/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA4 P48058 1/20 0.39
LRRK2 Q5S007 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38

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
SCHEMBL10980808 0.81 ADRA2C (0.68) ADRA2CPGRUSP7CLK4CNR1
SCHEMBL3536418 0.80 BCL2 (0.43) CTSSCTSKLRRK2
SCHEMBL29068276 0.80 CLK4 (0.44) ADRA2CPGRCLK4BRD4LRRK2
SCHEMBL5086336 0.79 ADRA2C (0.44) ADRA2CPGRUSP7CLK4CNR1
SCHEMBL20774359 0.78 CLK4 (0.45) ADRA2CCLK4BRD4GABRG2GABRB3
SCHEMBL5685480 0.77 DPP4 (0.39)
SCHEMBL28589926 0.77 ADRA2C (0.47) ADRA2CCLK4GABRG2GABRB3GABRA5
SCHEMBL2673331 0.73 KDM4E (0.51) ADRA2CPGRUSP7CLK4HCAR2
SCHEMBL16455741 0.71 USP7 (0.50) ADRA2CUSP7CLK4CTSSCTSK
SCHEMBL1202557 0.71 CLK4 (0.50) ADRA2CPGRCLK4GABRG2GABRB3

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-2509978-A1 AZOCYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE E.I. Du Pont De Nemours And Company (US) 2012-10-17 EP disclosed
WO-2011072207-A1 AZOCYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-16 WO disclosed