SCHEMBL6095903

SCHEMBL6095903

CC(C)CCC(N1CCCC(c2ccsc2)C1)S(=O)(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 3/20 0.40
DRD2 P14416 7/20 0.37
HTR7 P34969 2/20 0.37
HTR1A P08908 1/20 0.37
HTR1B P28222 1/20 0.37
HTR2A P28223 1/20 0.37
BCL9 O00512 1/20 0.35
CTNNB1 P35222 1/20 0.35
DRD3 P35462 6/20 0.35
DRD1 P21728 1/20 0.34
DRD4 P21917 1/20 0.34
DRD5 P21918 1/20 0.34
GRM2 Q14416 1/20 0.33
RORC P51449 1/20 0.32

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
SCHEMBL6099635 0.82 LMNA (0.45) CCR5DRD2HTR7HTR1AHTR1B
SCHEMBL6098434 0.82 DRD2 (0.37) CCR5DRD2HTR7HTR1AHTR1B
SCHEMBL6098065 0.82 ALDH1A1 (0.47) DRD2HTR7HTR1AHTR1BHTR2A
SCHEMBL6096322 0.81 CCR5 (0.43) CCR5DRD2HTR7HTR1AHTR1B
SCHEMBL6095722 0.78 ALDH1A1 (0.37) DRD2HTR7HTR1AHTR1BHTR2A
SCHEMBL6095467 0.78 RORC (0.46) RORC
SCHEMBL6096991 0.77 KDM4E (0.34) CCR5DRD2HTR7HTR1AHTR1B
SCHEMBL6097505 0.76 RORC (0.34) DRD2HTR7HTR1AHTR1BHTR2A
SCHEMBL6095436 0.76 CYP2C19 (0.41) RORC
SCHEMBL6097882 0.76 RORC (0.34) DRD2HTR7HTR1AHTR1BHTR2A

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 CCR5 606/4885DRD2 74/4885HTR7 1/4885

“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.