SCHEMBL7427735

SCHEMBL7427735

FC(F)(F)c1ccc(OC(CCN2CCN(c3ccccc3)CC2)c2cccs2)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 14/20 0.67
SLC7A5 Q01650 1/20 0.55
CACNA2D1 P54289 1/20 0.48

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
SCHEMBL350747 0.86 HTR1A (0.88) HTR1A
SCHEMBL7427779 0.86 SLC7A5 (0.61) HTR1ASLC7A5CACNA2D1
SCHEMBL7437571 0.85 HTR1A (0.55) HTR1ACACNA2D1
SCHEMBL7443700 0.85 HTR1A (0.63) HTR1A
SCHEMBL10053312 0.79 HTR1A (0.76) HTR1A
SCHEMBL10052737 0.77 HTR1A (0.80) HTR1A
SCHEMBL349866 0.77 HTR1A (0.69) HTR1ASLC7A5
SCHEMBL7431833 0.77 HTR1A (0.74) HTR1A
SCHEMBL7435344 0.75 HTR1A (0.55) HTR1A
SCHEMBL10052723 0.74 HTR1A (1.00) HTR1A

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