SCHEMBL8650215

SCHEMBL8650215

O=C(O)NS(=O)(=O)C1CCc2ccccc2O1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.46
SSTR4 P31391 1/20 0.39
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HTR1A P08908 3/20 0.36
SIGMAR1 Q99720 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
DRD2 P14416 3/20 0.34
DRD4 P21917 3/20 0.34
DRD3 P35462 3/20 0.34
HTR1D P28221 1/20 0.34
DRD1 P21728 1/20 0.34
DRD5 P21918 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
HSD11B1 P28845 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
SCHEMBL8650317 0.89 CA2 (0.49) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL8650607 0.83 CA2 (0.47) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL6464770 0.79 CA2 (0.49) CA2SSTR4HDAC3HDAC1HDAC2
Acetic Acid SCHEMBL27984668 0.78 CA2 (0.44) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL1365698 0.76 CA2 (0.47) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6591026 0.75 CA2 (0.56) CA2SSTR4HTR1ASIGMAR1ADRA2A
SCHEMBL4672085 0.75 CA2 (0.49) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL6591970 0.73 CA2 (0.45) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL6591968 0.72 CA2 (0.44) CA2SSTR4HDAC3HDAC1HDAC2
SCHEMBL8660419 0.71 CA2 (0.43) CA2SSTR4HDAC3HDAC1HDAC2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5849755-A 3-amidochromanylsulfonyl(thio)ureas, processes for their preparation, their use, and pharmaceutical preparations comprising them HOECHST AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
US-5811448-A PHARMACEUTICALS USEFUL FOR THE TREATMENT OF CARDIAC ARRHYTHMIAS HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-22 US disclosed