SCHEMBL4616767

SCHEMBL4616767

O=S(=O)(NCCc1ccccc1)c1cccc(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.71
PRMT1 Q99873 2/20 0.71
SFRP1 Q8N474 1/20 0.71
AKR1C3 P42330 2/20 0.68
HDAC2 Q92769 1/20 0.63
HDAC8 Q9BY41 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63
TAAR1 Q96RJ0 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
HSD17B10 Q99714 1/20 0.59
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
MAPT P10636 1/20 0.55
POLB P06746 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
SCHEMBL27712948 0.91 PRMT1 (0.64) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4618598 0.90 SFRP1 (0.60) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4617723 0.90 AKR1C3 (0.69) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4618968 0.90 TAAR1 (0.68) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4617870 0.90 ALDH1A1 (0.71) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4618106 0.90 TDP1 (0.76) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4616446 0.89 SFRP1 (0.58) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4672142 0.89 AKR1C3 (0.70) ALDH1A1PRMT1SFRP1AKR1C3HDAC2
SCHEMBL4618403 0.89 CA1 (0.77) ALDH1A1PRMT1SFRP1AKR1C3TDP1
SCHEMBL4618861 0.87 AKR1C3 (0.71) ALDH1A1PRMT1SFRP1AKR1C3POLB

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
CN-101208299-A Diarylsulfone sulfonamides and use therof WYETH CORP (US) 2008-06-25 CN claimed
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
CN-101208299-A Diarylsulfone sulfonamides and use therof WYETH CORP (US) 2008-06-25 CN disclosed
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 ALDH1A1 1865/4885PRMT1 867/4885SFRP1 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.