SCHEMBL7982671

SCHEMBL7982671

CCCCCCCCC(C)C(=O)NC(C)CO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.64
CA1 P00915 2/20 0.48
ACE2 Q9BYF1 1/20 0.44
KCNK3 O14649 1/20 0.44
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44
CNR2 P34972 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.44
FAAH O00519 2/20 0.43
ASAH1 Q13510 1/20 0.43
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH4 P08319 1/20 0.42
ADH7 P40394 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL7992939 1.00 CNR1 (0.64) CNR1CA1ACE2KCNK3ALDH1A1
SCHEMBL22304123 0.93 CNR1 (0.63) CNR1CA1KCNK3ALDH1A1THRB
SCHEMBL7981241 0.83 CA2 (0.51) CNR1CA1KCNK3ALDH1A1THRB
SCHEMBL24125240 0.81 CNR1 (0.51) CNR1CA1ACE2MEN1KMT2A
SCHEMBL25761064 0.81 CA1 (0.55) CNR1CA1ACE2MEN1KMT2A
SCHEMBL7028999 0.79 CA1 (0.57) CA1ACE2FAAHCCR2
SCHEMBL8313862 0.79 CNR1 (1.00) CNR1KCNK3ALDH1A1THRBCNR2
SCHEMBL13963510 0.79 FAAH (0.62) CA1ACE2FAAH
SCHEMBL13963508 0.79 FAAH (0.62) CA1ACE2FAAH
SCHEMBL13963509 0.79 FAAH (0.62) CA1ACE2FAAH

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
WO-2009126502-A2 METHODS OF INHIBITING AND TREATING BIOFILMS USING GLYCOPEPTIDE ANTIBIOTICS TARGANTA THERAPEUTICS CORP. (US) 2009-10-15 WO disclosed