SCHEMBL6097225

SCHEMBL6097225

CC(CCN1CCC(C(F)(F)F)CC1)C(C)S(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.52
CCR5 P51681 6/20 0.40
HTR2A P28223 2/20 0.39
KCNH2 Q12809 2/20 0.39
HTR2C P28335 1/20 0.39
NR1H2 P55055 1/20 0.39
DRD2 P14416 1/20 0.38
HTR1D P28221 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL6097772 0.83 HTR7 (0.50) HTR7CCR5HTR2AKCNH2HTR2C
SCHEMBL6098357 0.80 HTR7 (0.47) HTR7CCR5HTR2AKCNH2HTR2C
SCHEMBL6096555 0.80 HTR7 (0.52) HTR7CCR5HTR2AKCNH2HTR2C
Hydrochloric Acid SCHEMBL6096966 0.79 HTR7 (0.46) HTR7CCR5HTR2AKCNH2HTR2C
SCHEMBL6096980 0.75 HTR7 (0.48) HTR7CCR5HTR2AKCNH2HTR2C
SCHEMBL6096562 0.74 HTR7 (0.38) HTR7NR1H2
SCHEMBL6098066 0.73 HTR7 (0.42) HTR7NR1H2DRD2DRD3
SCHEMBL6098060 0.73 HTR7 (0.60) HTR7HTR2AKCNH2HTR2CDRD2
SCHEMBL6097778 0.71 HTR7 (0.43) HTR7NR1H2DRD2DRD3
SCHEMBL6096984 0.71 HTR7 (0.42) HTR7NR1H2

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 1/4885CCR5 606/4885HTR2A 12/4885

“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.