SCHEMBL8112469

SCHEMBL8112469

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.44
HTR1A P08908 7/20 0.34
SIGMAR1 Q99720 2/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
HTR1D P28221 5/20 0.32
SSTR4 P31391 1/20 0.32
HSD11B1 P28845 1/20 0.32
CA1 P00915 2/20 0.31

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
SCHEMBL8117879 0.87 CA2 (0.43) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6464770 0.76 CA2 (0.49) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL6591026 0.76 CA2 (0.56) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL4672085 0.76 CA2 (0.49) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL1365698 0.74 CA2 (0.47) CA2HTR1ASIGMAR1ADRA2AADRA2B
Acetic Acid SCHEMBL27984668 0.71 CA2 (0.44) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL8650317 0.70 CA2 (0.49) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL8650215 0.70 CA2 (0.46) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL95677 0.69 CA2 (0.44) CA2HTR1ASIGMAR1ADRA2AADRA2B
SCHEMBL1136752 0.68 CA2 (0.44) CA2HTR1ASIGMAR1ADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0779288-B1 Substituted chromanylsulfonyl(thio)ureas, process for their preparation, their use in pharmaceutical compositions and preparations containing them HOECHST AG (DE) 2000-03-29 EP disclosed
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
EP-0779288-A1 Substituted chromanylsulfonyl(thio)ureas, process for their preparation, their use in pharmaceutical compositions and preparations containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-06-18 EP disclosed