SCHEMBL4616985

SCHEMBL4616985

COC(=O)CCNS(=O)(=O)c1cccc(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
CA12 O43570 3/20 0.52
CA7 P43166 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA9 Q16790 2/20 0.52
ATM Q13315 1/20 0.52
MEP1B Q16820 1/20 0.49
SFRP1 Q8N474 1/20 0.47
AKR1C3 P42330 3/20 0.47
CA1 P00915 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
TBXA2R P21731 1/20 0.46

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
SCHEMBL9464524 0.87 CA12 (0.61) ALDH1A1CA12CA7CA14CA9
SCHEMBL4617795 0.86 SFRP1 (0.67) ALDH1A1CA12CA7CA14CA9
SCHEMBL4617937 0.86 ATM (0.69) ALDH1A1ATMMEP1BSFRP1AKR1C3
SCHEMBL4617234 0.85 SFRP1 (0.64) ALDH1A1CA12CA7CA14CA9
SCHEMBL4617169 0.85 SFRP1 (0.57) ALDH1A1ATMSFRP1MAPK1KMT2A
SCHEMBL4617581 0.83 ATM (0.55) ALDH1A1ATMMEP1BSFRP1AKR1C3
SCHEMBL4617091 0.82 MAPK1 (0.61) ALDH1A1SFRP1MAPK1KMT2A
SCHEMBL4618001 0.80 MAPK1 (0.76) ALDH1A1SFRP1MAPK1KMT2A
SCHEMBL4619610 0.80 MAPK1 (0.53) ALDH1A1ATMSFRP1AKR1C3CYP2C19
SCHEMBL28147718 0.79 ALDH1A1 (0.71) ALDH1A1CA12CA7CA14CA9

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 ALDH1A1 1865/4885CA12 1740/4885CA7 2247/4885

“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.