SCHEMBL15048972

SCHEMBL15048972

O=C(O)c1cccnc1OC(=O)N1CCC(Oc2ccc(OCc3cccc(F)c3)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.62
NR4A2 P43354 2/20 0.47
GRIN2B Q13224 1/20 0.47
MAOB P27338 10/20 0.47
MAOA P21397 7/20 0.47
F10 P00742 2/20 0.46
MMP13 P45452 1/20 0.44
MMP14 P50281 1/20 0.44
ACACB O00763 1/20 0.42
PARP10 Q53GL7 1/20 0.41
KDM1A O60341 1/20 0.41
F2 P00734 1/20 0.41
ELANE P08246 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL15048973 0.85 FAAH (0.63) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL12736299 0.83 FAAH (0.63) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL1532790 0.83 FAAH (0.68) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL12736284 0.82 FAAH (0.62) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL1532715 0.81 FAAH (0.62) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL29976154 0.81 FAAH (0.62) FAAHNR4A2GRIN2BMAOBMAOA
SCHEMBL12736300 0.79 FAAH (0.64) FAAHGRIN2BMAOBMAOAF10
SCHEMBL13806489 0.78 FAAH (0.68) FAAHNR4A2MAOBMAOAMMP13
SCHEMBL2195218 0.78 FAAH (0.65) FAAHNR4A2MAOBMAOAMMP13
SCHEMBL16333042 0.77 FAAH (0.61) FAAHMAOBMAOAMMP13MMP14

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-2607362-A1 Piperidine and piperazine carboxylates as FAAH inhibitors Astellas Pharma Inc. (JP) 2013-06-26 EP disclosed