SCHEMBL4616745

SCHEMBL4616745

O=S(=O)(NCCCN1CCOCC1)c1cccc(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.69
ALDH1A1 P00352 1/20 0.67
TDP1 Q9NUW8 1/20 0.66
KMT2A Q03164 1/20 0.61
SFRP1 Q8N474 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C19 P33261 1/20 0.60
KDM4E B2RXH2 1/20 0.56
HTR7 P34969 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL4618073 0.93 ALDH1A1 (0.62) POLBALDH1A1TDP1KMT2ASFRP1
SCHEMBL4618720 0.90 SFRP1 (0.73) POLBALDH1A1TDP1SFRP1HTR7
SCHEMBL13045322 0.89 KMT2A (0.76) POLBALDH1A1TDP1KMT2ANPSR1
SCHEMBL4638749 0.87 SFRP1 (0.66) POLBALDH1A1TDP1KMT2ASFRP1
SCHEMBL4616665 0.87 SFRP1 (0.65) POLBALDH1A1TDP1SFRP1HTR7
SCHEMBL4618034 0.84 SFRP1 (0.60) POLBALDH1A1TDP1KMT2ASFRP1
SCHEMBL8292850 0.82 TDP1 (0.68) POLBALDH1A1TDP1KMT2ANPSR1
SCHEMBL4617661 0.81 SFRP1 (0.61) ALDH1A1SFRP1NPSR1KDM4EHTR7
SCHEMBL3719058 0.81 PKM (0.69) POLBALDH1A1KMT2AHTR7
SCHEMBL23718088 0.80 L3MBTL1 (0.80) POLBALDH1A1TDP1KMT2ANPSR1

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 4 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
US-20060276464-A1 Diarylsulfone sulfonamides and use thereof WYETH (US) 2006-12-07 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-20060276464-A1 Diarylsulfone sulfonamides and use thereof SFRP1, SOS1, FZD7 POLB 4876/4885ALDH1A1 1865/4885TDP1 4520/4885

“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.