SCHEMBL15048973

SCHEMBL15048973

O=C(O)c1cnccc1OC(=O)N1CCC(Oc2ccc(OCc3cccc(F)c3)cc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.63
F10 P00742 4/20 0.46
NR4A2 P43354 2/20 0.45
GRIN2B Q13224 1/20 0.43
MMP13 P45452 1/20 0.43
MMP14 P50281 1/20 0.43
MAOB P27338 5/20 0.43
MAOA P21397 3/20 0.43
F2 P00734 1/20 0.42
ELANE P08246 1/20 0.42
BTK Q06187 4/20 0.42
ACACB O00763 1/20 0.42
PARP10 Q53GL7 1/20 0.40

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
SCHEMBL12736300 0.87 FAAH (0.64) FAAHF10GRIN2BMMP13MMP14
SCHEMBL1532790 0.85 FAAH (0.68) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL15048972 0.85 FAAH (0.62) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL29976154 0.83 FAAH (0.62) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL1532715 0.83 FAAH (0.62) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL12736284 0.83 FAAH (0.62) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL12736299 0.82 FAAH (0.63) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL16333042 0.79 FAAH (0.61) FAAHMMP13MMP14MAOBMAOA
SCHEMBL1532895 0.78 FAAH (0.58) FAAHF10NR4A2GRIN2BMMP13
SCHEMBL1532894 0.78 FAAH (0.58) FAAHF10NR4A2GRIN2BMMP13

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