SCHEMBL6098059

SCHEMBL6098059

COc1ccc(C2CCCN(CCCC(C)(C)S(=O)(=O)c3ccccc3)C2)cc1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.82
HTR7 P34969 6/20 0.82
HTR1A P08908 3/20 0.82
HTR2A P28223 3/20 0.82
HTR1B P28222 1/20 0.82
DRD3 P35462 5/20 0.51
DRD1 P21728 4/20 0.51
DRD4 P21917 4/20 0.51
DRD5 P21918 4/20 0.51
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 1/20 0.46
HIF1A Q16665 1/20 0.46
RAB9A P51151 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL6096316 0.84 HTR7 (0.87) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6097054 0.82 HTR7 (0.72) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6098424 0.82 DRD2 (0.79) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6095895 0.82 DRD2 (0.79) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6095461 0.80 HTR7 (0.76) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6099630 0.80 HTR7 (0.75) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6097242 0.79 HTR7 (0.67) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6095714 0.79 DRD2 (0.74) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6096983 0.78 HTR7 (0.73) DRD2HTR7HTR1AHTR2AHTR1B
SCHEMBL6095930 0.78 HTR7 (0.88) DRD2HTR7HTR1AHTR2AHTR1B

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-7101892-B2 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. 2006-09-05 US disclosed
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 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-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands HTR7, HTR2C, HTR1A DRD2 74/4885HTR7 1/4885HTR1A 3/4885

“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.