SCHEMBL6097229

SCHEMBL6097229

CC(C)(CCCBr)S(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.48
DRD2 P14416 4/20 0.48
HTR1A P08908 3/20 0.48
HTR2A P28223 3/20 0.48
HTR1B P28222 1/20 0.48
PSIP1 O75475 1/20 0.39
HSD11B1 P28845 1/20 0.39
HTR6 P50406 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 5/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP2C19 P33261 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 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
SCHEMBL6095635 0.84 ALDH1A1 (0.47) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL6098260 0.83 TSHR (0.40) TDP1ALDH1A1SMN1; SMN2NPSR1KDM4E
SCHEMBL6099900 0.83 HTR7 (0.35) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL18852692 0.79 PSIP1 (0.48) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL6097428 0.79 KEAP1 (0.39) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL27645438 0.78 HTR7 (0.44) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL6095322 0.78 HSD11B1 (0.44) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL6097857 0.77 MMP1 (0.44) HSD11B1HTR6POLBSMN1; SMN2KDM4E
SCHEMBL13703524 0.75 PSIP1 (0.52) HTR7DRD2HTR1AHTR2AHTR1B
SCHEMBL7296391 0.75 PSIP1 (0.46) HTR7DRD2HTR1AHTR2AHTR1B

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 HTR7 1/4885DRD2 74/4885HTR1A 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.