SCHEMBL4617522

SCHEMBL4617522

CC(C)c1cc(C(C)C)c(S(=O)(=O)c2ccccc2)cc1S(=O)(=O)NCCc1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 10/20 0.49
SFRP1 Q8N474 1/20 0.48
NAMPT P43490 2/20 0.46
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
POLB P06746 1/20 0.42
TBXA2R P21731 1/20 0.42

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
SCHEMBL4617716 0.91 TBXAS1 (0.51) TBXAS1SFRP1NAMPTALDH1A1HTT
SCHEMBL4639266 0.89 SFRP1 (0.59) SFRP1ALDH1A1HTTSMN1; SMN2TDP1
SCHEMBL4617818 0.89 SFRP1 (0.58) TBXAS1SFRP1NAMPTTDP1
SCHEMBL4616471 0.88 TDP1 (0.60) SFRP1ALDH1A1HTTSMN1; SMN2TDP1
SCHEMBL4619118 0.82 TAAR1 (0.60) SFRP1ALDH1A1HTTSMN1; SMN2TDP1
SCHEMBL4616742 0.81 ACHE (0.53) SFRP1ALDH1A1HTTTDP1
SCHEMBL4619248 0.81 TBXAS1 (0.53) TBXAS1SFRP1NAMPTALDH1A1HTT
SCHEMBL4618000 0.78 ALDH1A1 (0.49) SFRP1ALDH1A1HTTSMN1; SMN2TDP1
SCHEMBL27713238 0.78 TDP1 (0.70) TBXAS1ALDH1A1TDP1TBXA2R
Hydrochloric Acid SCHEMBL1238218 0.77 TDP1 (0.68) TBXAS1ALDH1A1TDP1TBXA2R

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 TBXAS1 2485/4885SFRP1 1/4885NAMPT 3852/4885

“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.