SCHEMBL15219065

SCHEMBL15219065

CC(C)(OC1CCOCC1)C(=O)Nc1ccc(C(F)(F)F)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.47
HIF1A Q16665 1/20 0.47
EPAS1 Q99814 1/20 0.47
PDE10A Q9Y233 1/20 0.45
RAB9A P51151 2/20 0.44
PTGS1 P23219 1/20 0.44
NPC1 O15118 1/20 0.44
EPHX2 P34913 1/20 0.42
GAA P10253 2/20 0.42
IKBKE Q14164 1/20 0.42
TBK1 Q9UHD2 1/20 0.42
HCRTR1 O43613 2/20 0.41
POLB P06746 1/20 0.41
DEGS1 O15121 2/20 0.41
GRM5 P41594 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
FPR1 P21462 1/20 0.40
FPR2 P25090 1/20 0.40
CNR1 P21554 1/20 0.39

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
SCHEMBL1621875 0.79 NPY5R (0.52) NPY5RHIF1AEPAS1RAB9APTGS1
SCHEMBL16358418 0.78 NPY5R (0.46) NPY5RHIF1AEPAS1PDE10ARAB9A
SCHEMBL3928750 0.78 RAB9A (0.58) NPY5RRAB9APTGS1NPC1GAA
SCHEMBL3661268 0.78 NPY5R (0.63) NPY5RHIF1AEPAS1PDE10ARAB9A
SCHEMBL1619860 0.77 CNR2 (0.51) NPY5RHIF1AEPAS1RAB9APTGS1
SCHEMBL16358415 0.75 NPC1 (0.48) NPY5RHIF1AEPAS1RAB9APTGS1
SCHEMBL14960390 0.75 NPY5R (0.47) NPY5RRAB9APTGS1NPC1EPHX2
SCHEMBL16359181 0.74 GAA (0.50) NPY5RHIF1AEPAS1RAB9APTGS1
SCHEMBL1465583 0.74 RAB9A (0.57) NPY5RRAB9APTGS1NPC1GAA
SCHEMBL14960396 0.74 RAB9A (0.46) NPY5RHIF1AEPAS1RAB9APTGS1

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
EP-2074084-B1 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2013-08-28 EP disclosed