SCHEMBL15920167

SCHEMBL15920167

CC(C)Oc1ccc(NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.64
NPY2R P49146 1/20 0.55
CACNA2D1 P54289 4/20 0.54
CACNA1B Q00975 4/20 0.54
CACNB1 Q02641 4/20 0.54
CACNA1C Q13936 3/20 0.54
KMT2A Q03164 5/20 0.52
MAPT P10636 2/20 0.52
PDGFRB P09619 2/20 0.52
MEN1 O00255 3/20 0.51
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.51
MGLL Q99685 1/20 0.51
CNR1 P21554 2/20 0.51
CNR2 P34972 2/20 0.51
OPRD1 P41143 1/20 0.49
CACNA1G O43497 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL15919857 0.88 MAPT (0.70) FAAHNPY2RCACNA2D1CACNA1BCACNB1
SCHEMBL15919867 0.86 NPY2R (0.73) NPY2RKMT2AMAPTMEN1LMNA
SCHEMBL15920163 0.85 NPY2R (0.76) FAAHNPY2RCACNA2D1CACNA1BCACNB1
SCHEMBL15920165 0.85 CACNA2D1 (0.68) FAAHCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL15920168 0.84 CACNA2D1 (0.61) FAAHCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL15920269 0.82 CA12 (0.64) CACNA2D1CACNA1BCACNB1CACNA1CKMT2A
SCHEMBL15920162 0.78 FAAH (0.60) FAAHCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL3604234 0.78 FAAH (1.00) FAAHMAPT
SCHEMBL15920004 0.78 FAAH (0.59) FAAHKMT2AMAPTPDGFRBMEN1
SCHEMBL13097610 0.77 POLB (0.58) FAAHKMT2AMAPTPDGFRBMEN1

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-2014116684-A1 NON-PEPTIDIC NEUROPEPTIDE Y RECEPTOR MODULATORS ROBERTS EDWARD (US) 2014-07-31 WO disclosed