SCHEMBL28802144

SCHEMBL28802144

O=C(O)N1CCC(NS(=O)(=O)c2cccc(Cl)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 10/20 0.59
HTR7 P34969 10/20 0.59
DRD2 P14416 2/20 0.54
HTR6 P50406 2/20 0.54
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HTR2A P28223 1/20 0.52
SFRP1 Q8N474 1/20 0.52
STS P08842 1/20 0.51
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HRH2 P25021 1/20 0.49
HRH1 P35367 1/20 0.49
KIT P10721 1/20 0.49
FBP1 P09467 1/20 0.48
HTT P42858 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
SCHEMBL17907549 0.85 CTSL (0.61) HTR1AHTR7ALDH1A1LMNA
SCHEMBL27917822 0.84 HTT (0.62) HTR1AHTR7HDAC8SFRP1STS
SCHEMBL27900131 0.81 FBP1 (0.57) HTR1AHTR7DRD2HTR6HDAC8
SCHEMBL27772044 0.81 ALDH1A1 (0.57) HTR1AHTR7DRD2HTR6HDAC8
SCHEMBL14834140 0.80 MGLL (0.57) HTR1AHTR7DRD2HTR6HTR2A
SCHEMBL4737973 0.80 HDAC8 (0.53) HTR1AHTR7DRD2HDAC8SFRP1
SCHEMBL2097769 0.80 KMT2A (0.65) HTR7DRD2HTR6HTR2ASFRP1
SCHEMBL16825813 0.79 SIGMAR1 (0.49) HTR1AHTR7ALDH1A1LMNAHTT
SCHEMBL3806249 0.78 CTSK (0.65) HTR1AHTR7ALDH1A1LMNA
SCHEMBL4785389 0.77 ALDH1A1 (0.51) HTR1AHTR7SFRP1STSALDH1A1

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
CN-103068797-A Hexafluoroisopropyl carbamate derivatives, their preparation and their therapeutic application SANOFI SA 2013-04-24 CN disclosed