SCHEMBL6097288

SCHEMBL6097288

O=S(=O)(c1cc(Cl)c(Cl)cc1Cl)C1(CCCN2CCC(c3ccccc3)C2)CCC1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.72
HTR1A P08908 4/20 0.54
HTR2A P28223 3/20 0.54
DRD2 P14416 2/20 0.43
HTR1B P28222 1/20 0.43
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD11B1 P28845 3/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
DRD3 P35462 1/20 0.39

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
SCHEMBL6099006 0.84 HTR7 (1.00) HTR7HTR1AHTR2ADRD2HTR1B
SCHEMBL6096886 0.82 HTR7 (0.72) HTR7HTR1AHTR2ADRD2HTR1B
SCHEMBL6098063 0.70 HTR7 (1.00) HTR7HTR1AHTR2ADRD2DRD3
SCHEMBL6097856 0.70 HTR7 (0.35) HTR7HTR1AHTR2A
SCHEMBL25946287 0.65 DRD2 (0.69) HTR1ADRD2KMT2ADRD1DRD4
SCHEMBL6096316 0.64 HTR7 (0.87) HTR7HTR1AHTR2ADRD2HTR1B
SCHEMBL12209894 0.64 KMT2A (0.66) HTR7DRD2ALDH1A1LMNAGAA
SCHEMBL24755587 0.64 DRD1 (0.70) HTR1ADRD2KMT2ADRD1DRD4
Hydrochloric Acid SCHEMBL25366342 0.63 KMT2A (0.60) HTR7DRD2ALDH1A1LMNAGAA
Hydrochloric Acid SCHEMBL31224123 0.62 TACR2 (0.73)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 US claimed
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 1/4885HTR1A 3/4885HTR2A 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.