SCHEMBL7097826

SCHEMBL7097826

Fc1c(Br)cccc1OC1CCC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.45
SLC6A3 Q01959 3/20 0.45
SLC6A4 P31645 1/20 0.45
MCHR1 Q99705 3/20 0.39
HTR1A P08908 3/20 0.37
AR P10275 1/20 0.36
POLB P06746 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
SCD O00767 1/20 0.34
HRH1 P35367 3/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 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
SCHEMBL7102061 0.96 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4MCHR1HTR1A
SCHEMBL14857951 0.95 MCHR1 (0.44) SLC6A2SLC6A3SLC6A4MCHR1HTR1A
SCHEMBL25385511 0.93 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4MCHR1HTR1A
SCHEMBL12489166 0.85 KAT2B (0.44) SLC6A2SLC6A3SLC6A4HTR1AAR
SCHEMBL24682361 0.84 POLB (0.39) SLC6A2SLC6A3SLC6A4HTR1APOLB
SCHEMBL4504051 0.82 KDM4E (0.44) SLC6A2SLC6A3SLC6A4HTR2CHTR2B
SCHEMBL16333708 0.81 HRH1 (0.41) SLC6A2SLC6A3MCHR1HTR1APOLB
SCHEMBL29150466 0.80 POLB (0.39) SLC6A2SLC6A3SLC6A4MCHR1POLB
SCHEMBL19510885 0.79 MCHR1 (0.39) MCHR1POLBHTR2CHTR2BHRH1
SCHEMBL13537681 0.79 MCHR1 (0.45) SLC6A2SLC6A3SLC6A4MCHR1HTR1A

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
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed