SCHEMBL4638693

SCHEMBL4638693

CC(C)c1ccccc1S(=O)(=O)NC1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.46
HTR6 P50406 6/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
BRD4 O60885 1/20 0.42
HTR1A P08908 9/20 0.41
HTR7 P34969 9/20 0.41
HTR2A P28223 1/20 0.39
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CCR8 P51685 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
SCHEMBL15614423 0.90 L3MBTL1 (0.51) DRD2HTR6MAPTALDH1A1L3MBTL1
SCHEMBL16849228 0.84 BRD4 (0.49) DRD2HTR6BRD4HTR1AHTR7
SCHEMBL4734388 0.83 CCR8 (0.46) DRD2HTR6MAPTALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL4734829 0.82 CCR8 (0.46) DRD2HTR6MAPTALDH1A1L3MBTL1
SCHEMBL4616096 0.81 SFRP1 (0.49) ALDH1A1L3MBTL1
SCHEMBL4618843 0.81 ALDH1A1 (0.39) DRD2HTR6ALDH1A1L3MBTL1MEN1
SCHEMBL4727780 0.81 CTSL (0.40) DRD2HTR6MAPTALDH1A1L3MBTL1
SCHEMBL13162704 0.81 PKM (0.51) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL6101380 0.80 HTR1A (0.41) DRD2HTR6MAPTALDH1A1BRD4
SCHEMBL4782205 0.79 CA1 (0.50) DRD2HTR6MAPTALDH1A1L3MBTL1

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
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 DRD2 4401/4885HTR6 3789/4885MAPT 4680/4885

“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.