SCHEMBL1423765

SCHEMBL1423765

O=S(=O)(NC1CNc2ccccc21)c1c(Cl)nc2sccn12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.46
HTR6 P50406 17/20 0.45
ADRA2A P08913 2/20 0.45
HTR2C P28335 2/20 0.45
MET P08581 1/20 0.43
CCKBR P32239 1/20 0.41
CYP3A4 P08684 1/20 0.39
CYP2A6 P11509 1/20 0.39
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39

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
Hydrochloric Acid SCHEMBL1423306 0.99 ACLY (0.45) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1423427 0.89 HTR6 (0.35) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422160 0.81 ACLY (0.52) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1421917 0.80 ALDH1A1 (0.47) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422456 0.80 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422682 0.78 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1590549 0.78 HTR6 (0.47) HTR6
Hydrochloric Acid SCHEMBL1590417 0.77 HTR6 (0.46) HTR6
SCHEMBL1423772 0.77 ACLY (0.45) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422004 0.76 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET

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