SCHEMBL4619043

SCHEMBL4619043

CC(C)c1ccc(S(=O)(=O)c2ccc(F)cc2)cc1S(=O)(=O)NC1CCSCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 10/20 0.42
HTR7 P34969 10/20 0.42
DRD2 P14416 5/20 0.42
HTR6 P50406 5/20 0.42
SFRP1 Q8N474 8/20 0.41
WNT3 P56703 3/20 0.41
HTR2A P28223 2/20 0.41
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 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
SCHEMBL4617920 0.92 HTR1A (0.45) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4616210 0.90 KDM4E (0.46) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4617601 0.90 HTR1A (0.44) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4617737 0.89 ALDH1A1 (0.46) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL6103313 0.87 HTR1A (0.42) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4617906 0.87 SFRP1 (0.56) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4615580 0.86 IKBKB (0.42) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4618933 0.86 HTR1A (0.41) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL4617898 0.85 HTR1A (0.36) HTR1AHTR7DRD2HTR6SFRP1
SCHEMBL6102396 0.82 SFRP1 (0.51) SFRP1WNT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP claimed
US-20060276464-A1 Diarylsulfone sulfonamides and use thereof WYETH (US) 2006-12-07 US claimed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO claimed
EP-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
US-20060276464-A1 Diarylsulfone sulfonamides and use thereof WYETH (US) 2006-12-07 US disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO 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-20060276464-A1 Diarylsulfone sulfonamides and use thereof SFRP1, SOS1, FZD7 HTR1A 3561/4885HTR7 3430/4885DRD2 4401/4885

“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.