SCHEMBL9726227

SCHEMBL9726227

O=S1(=O)c2ccccc2-c2ccccc2N1CCCN1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.72
HTR7 P34969 8/20 0.72
HTR1A P08908 6/20 0.72
HTR2A P28223 6/20 0.72
HTR6 P50406 6/20 0.72
DRD4 P21917 3/20 0.72
DRD3 P35462 3/20 0.72
ADRA2A P08913 1/20 0.72
ADRA2B P18089 1/20 0.72
ADRA2C P18825 1/20 0.72
HTR2C P28335 1/20 0.72
SLC6A4 P31645 1/20 0.72
ADRA1A P35348 1/20 0.72
HRH1 P35367 1/20 0.72
ADRA1B P35368 1/20 0.72
OPRK1 P41145 1/20 0.72
HTR5A P47898 1/20 0.72
SLC6A3 Q01959 1/20 0.72
KCNH2 Q12809 1/20 0.72
TMEM97 Q5BJF2 1/20 0.72

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
Fananserin SCHEMBL340722 0.83 HTR7 (1.00) DRD2HTR7HTR1AHTR2AHTR6
Fananserin SCHEMBL5779774 0.83 HTR7 (1.00) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL9726216 0.79 HTR2A (0.56) HTR7HTR2AHTR6HTR2C
SCHEMBL6991546 0.79 DRD2 (0.54) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL9757700 0.77 HTR7 (0.73) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL6996766 0.77 DRD2 (0.54) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL7000579 0.77 DRD2 (0.53) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL7000574 0.77 DRD2 (0.53) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL9757519 0.75 HTR7 (0.95) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL6999498 0.74 HTR1A (0.55) DRD2HTR7HTR1AHTR2AHTR6

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
US-5130313-A Central nervous system disorders, cardiovascular disorders or gastrointestinal disorders RHONE-POULENC SANTE (FR) 1992-07-14 US disclosed