SCHEMBL4206145

SCHEMBL4206145

COc1ccc(NS(=O)(=O)c2ccccc2S(=O)(=O)c2ccccc2)c2c1C[C@@H](N(C)C)CO2

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.44
QRFPR Q96P65 1/20 0.44
HTR7 P34969 1/20 0.38
MCOLN2 Q8IZK6 1/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
MCOLN1 Q9GZU1 1/20 0.36
ACLY P53396 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
ERAP2 Q6P179 1/20 0.35
ERAP1 Q9NZ08 1/20 0.35
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BRD1 O95696 1/20 0.34
BRPF1 P55201 1/20 0.34
BRPF3 Q9ULD4 1/20 0.34

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
SCHEMBL4209213 0.90 HTR6 (0.47) HTR6QRFPRHTR7MCOLN2MCOLN3
SCHEMBL4204325 0.89 HTR6 (0.46) HTR6QRFPRHTR7ACLYALDH1A1
SCHEMBL4216791 0.87 HTR6 (0.46) HTR6QRFPRHTR7ALDH1A1BRD1
SCHEMBL4209019 0.87 HTR6 (0.44) HTR6QRFPRHTR7ACLY
SCHEMBL4201082 0.87 HTR6 (0.45) HTR6QRFPRHTR7ACLYL3MBTL1
SCHEMBL4198408 0.87 HTR6 (0.49) HTR6QRFPRHTR7ACLYALDH1A1
Acetic Acid SCHEMBL4208418 0.87 HTR6 (0.44) HTR6QRFPRHTR7MCOLN2MCOLN3
SCHEMBL4207623 0.87 HTR6 (0.45) HTR6QRFPRHTR7ACLYALDH1A1
SCHEMBL4209991 0.86 HTR6 (0.38) HTR6QRFPRHTR7MCOLN2MCOLN3
SCHEMBL4210019 0.85 SLC22A12 (0.45) HTR6QRFPRHTR7ALDH1A1KMT2A

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-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor ASTRAZENECA AB (SE) 2009-01-29 US claimed
US-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor ASTRAZENECA AB (SE) 2009-01-29 US 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-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor HTR6, HTR1A, HTR1D HTR6 1/4885QRFPR 81/4885HTR7 7/4885

“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.