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SCHEMBL1422456

SCHEMBL1422456

O=C1CC(NS(=O)(=O)c2c(Cl)nc3sccn23)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 1/20 0.46
▸ HTR6 P50406 16/20 0.43
▸ ADRA2A P08913 2/20 0.43
▸ HTR2C P28335 2/20 0.43
▸ BCL2 P10415 1/20 0.42
▸ BCL2L1 Q07817 1/20 0.42
▸ 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
SCHEMBL1422205 0.89 NTRK1 (0.38) ACLYHTR6ADRA2AHTR2CBCL2
SCHEMBL1422160 0.81 ACLY (0.52) ACLYHTR6ADRA2AHTR2CBCL2
SCHEMBL1421917 0.80 ALDH1A1 (0.47) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1423765 0.80 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET
Hydrochloric Acid SCHEMBL1423306 0.79 ACLY (0.45) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422682 0.78 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1422004 0.78 ACLY (0.46) ACLYHTR6ADRA2AHTR2CMET
SCHEMBL1590311 0.78 HTR6 (0.47) HTR6
SCHEMBL1423772 0.77 ACLY (0.45) ACLYHTR6ADRA2AHTR2CBCL2
SCHEMBL1590232 0.70 HTR6 (0.35) HTR6

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