SCHEMBL5790470

SCHEMBL5790470

Fc1ccc(-c2ccccc2-c2ccccc2CCC2CNCCO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.46
SLC6A3 Q01959 5/20 0.46
SLC6A4 P31645 10/20 0.41
KDM1A O60341 1/20 0.41
ADRB2 P07550 1/20 0.40
HTR1A P08908 1/20 0.40
HTR2A P28223 1/20 0.40
ADRA1A P35348 1/20 0.40
HTR2B P41595 1/20 0.40
ADRA2C P18825 1/20 0.40
CHEK1 O14757 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
SCHEMBL5788434 0.91 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL5789337 0.87 CHEK1 (0.43) SLC6A2SLC6A3SLC6A4CHEK1
SCHEMBL5791315 0.80 ADRA2C (0.51) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL5791765 0.78 SLC6A2 (0.62) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL7497207 0.76 DRD4 (0.51) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL8924483 0.72 DRD4 (0.51) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL78044 0.72 DRD4 (0.51) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL13708222 0.71 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL13708220 0.71 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL4082354 0.71 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716126-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-11-02 EP disclosed
WO-2005066144-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-07-21 WO disclosed