SCHEMBL7435335

SCHEMBL7435335

FC(F)(F)c1ccc(OC(CCN2CCCCC2)c2ccsc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.68
SLC6A4 P31645 4/20 0.54
HRH3 Q9Y5N1 2/20 0.54
CCR2 P41597 2/20 0.46
LTA4H P09960 1/20 0.45
SLC6A2 P23975 2/20 0.43
SLC6A3 Q01959 2/20 0.43

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
SCHEMBL7436298 0.89 HTR1A (0.66) HTR1ASLC6A4HRH3SLC6A2SLC6A3
SCHEMBL7434915 0.89 HTR1A (0.71) HTR1ASLC6A4HRH3
SCHEMBL7444890 0.88 HTR1A (0.57) HTR1ASLC6A4HRH3CCR2LTA4H
SCHEMBL7444624 0.82 HRH3 (0.55) HTR1ASLC6A4HRH3CCR2LTA4H
SCHEMBL7434240 0.81 SLC6A4 (0.61) HTR1ASLC6A4HRH3LTA4HSLC6A2
Hydrochloric Acid SCHEMBL6601400 0.81 HTR1A (0.98) HTR1A
SCHEMBL7427779 0.81 SLC7A5 (0.61) HTR1ASLC6A4HRH3LTA4HSLC6A2
SCHEMBL7435052 0.79 HRH3 (0.62) HTR1ASLC6A4HRH3LTA4H
Oxalic Acid SCHEMBL4739539 0.78 HTR1A (0.66) HTR1ASLC6A4HRH3CCR2
SCHEMBL7430403 0.78 SLC6A4 (0.57) HTR1ASLC6A4HRH3SLC6A2SLC6A3

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-0571685-A1 Aryloxyheteroarylpropylamines, their preparation and use NOVO NORDISK A/S (DK) 1993-12-01 EP disclosed