SCHEMBL5169875

SCHEMBL5169875

NC1(c2ccc(F)c(F)c2)CCN(C(=O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 4/20 0.39
CCR2 P41597 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HCAR3 P49019 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
DPP4 P27487 1/20 0.35
KCNH2 Q12809 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
DRD2 P14416 1/20 0.34
SLC6A2 P23975 3/20 0.33
APP P05067 1/20 0.33

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
SCHEMBL3384526 0.83 DRD2 (0.45) KMT2AMEN1DRD2
SCHEMBL29087345 0.80 JAK2 (0.45) KMT2AMEN1DPP4HDAC1HDAC2
SCHEMBL3602790 0.79 SLC6A4 (0.43) SLC6A4SLC6A3CCR2KMT2AMEN1
SCHEMBL3901441 0.79 SMN1; SMN2 (0.49) KMT2AMEN1DPP4HDAC1HDAC2
SCHEMBL1650477 0.78 SLC6A4 (0.52) SLC6A4SLC6A3SLC6A2
SCHEMBL30034514 0.78 SLC6A4 (0.52) SLC6A4SLC6A3SLC6A2
SCHEMBL23647568 0.78 CNR2 (0.43) SLC6A4SLC6A3CCR2KMT2AMEN1
SCHEMBL2531562 0.78 DRD2 (0.41) CCR2KMT2AMEN1DRD2
SCHEMBL10322683 0.77 OPRM1 (0.47) KMT2AMEN1AKR1C1TET3FBXL19
SCHEMBL4662764 0.76 CA12 (0.43)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773823-B1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-08-21 EP disclosed
EP-1773823-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-18 EP disclosed
WO-2006021654-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 WO disclosed