SCHEMBL1880552

SCHEMBL1880552

O=S(=O)(Nc1nccc2ccccc12)c1c(Cl)nc2sccn12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.52
MET P08581 1/20 0.47
HTR6 P50406 17/20 0.46
HTR2C P28335 2/20 0.46
HTR7 P34969 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2A6 P11509 1/20 0.46
HTR2B P41595 1/20 0.46
CCKBR P32239 1/20 0.44
ADRB2 P07550 1/20 0.43
CHRM2 P08172 1/20 0.43
ADRA2A P08913 1/20 0.43
S1PR1 P21453 1/20 0.43
C5AR1 P21730 1/20 0.43
SLC6A2 P23975 1/20 0.43
FPR3 P25089 1/20 0.43
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
GPR183 P32249 1/20 0.43

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 SCHEMBL1880868 0.86 ACLY (0.39) ACLYMETHTR6HTR2CHTR7
SCHEMBL1590856 0.77 HTR6 (0.53) HTR6HTR7HTR2AADRA1A
SCHEMBL1423219 0.75 ACLY (0.56) ACLYHTR6HTR2CHTR7CYP3A4
SCHEMBL1879113 0.72 ACLY (0.53) ACLYMETHTR6CCKBR
SCHEMBL1422633 0.72 ACLY (0.58) ACLYMETHTR6HTR2CCCKBR
SCHEMBL13211040 0.72 HTR6 (0.52) ACLYMETHTR6HTR2CCCKBR
SCHEMBL1422202 0.71 HTR6 (0.57) HTR6HTR2CADRA2A
SCHEMBL1423218 0.71 ACLY (0.54) ACLYMETHTR6HTR2CCCKBR
SCHEMBL6039086 0.71 ACLY (0.47) ACLYHTR6CCKBR
SCHEMBL1423370 0.70 ACLY (0.53) ACLYHTR6CCKBR

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-20110105555-A1 SUBSTITUTED N-IMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS LABORATORIOS DE. DR. ESTEVE, S.A. (ES) 2011-05-05 US disclosed
EP-2116547-A1 Substituted N-imidazo(2, 1-b) thiazole-5-sulfonamide derivatives as 5-TH6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110105555-A1 SUBSTITUTED N-IMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS HTR6, HTR1A, HTR5A ACLY 3936/4885MET 1031/4885HTR6 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.