SCHEMBL1422004

SCHEMBL1422004

O=S(=O)(NC1OCc2ccccc21)c1c(Cl)nc2sccn12

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.46
HTR6 P50406 17/20 0.42
HTR2C P28335 2/20 0.41
ADRA2A P08913 1/20 0.41
MET P08581 1/20 0.41
CCKBR P32239 1/20 0.41

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
SCHEMBL1421917 0.80 ALDH1A1 (0.47) ACLYHTR6HTR2CADRA2AMET
SCHEMBL1422456 0.78 ACLY (0.46) ACLYHTR6HTR2CADRA2AMET
SCHEMBL1422160 0.77 ACLY (0.52) ACLYHTR6HTR2CADRA2AMET
SCHEMBL1423765 0.76 ACLY (0.46) ACLYHTR6HTR2CADRA2AMET
Hydrochloric Acid SCHEMBL1423306 0.75 ACLY (0.45) ACLYHTR6HTR2CADRA2AMET
SCHEMBL1422682 0.74 ACLY (0.46) ACLYHTR6HTR2CADRA2AMET
SCHEMBL1423772 0.73 ACLY (0.45) ACLYHTR6HTR2CADRA2AMET
SCHEMBL13211040 0.70 HTR6 (0.52) ACLYHTR6HTR2CMETCCKBR
SCHEMBL730731 0.69 HTR6 (0.48) ACLYHTR6HTR2CADRA2ACCKBR
SCHEMBL748742 0.69 HTR6 (0.48) ACLYHTR6HTR2CADRA2ACCKBR

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
EP-2297166-A1 SUBSTITUTED N-IMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS Laboratorios Del. Dr. Esteve, S.A. (ES) 2011-03-23 EP claimed