SCHEMBL4904503

SCHEMBL4904503

CCN(c1ccc(OCc2ccccc2)c(OC)c1)S(=O)(=O)c1ccc(C)c(C(=O)OC)c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 12/20 0.52
NFE2L2 Q16236 12/20 0.52
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 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
SCHEMBL4906067 0.93 KEAP1 (0.53) KEAP1NFE2L2SMN1; SMN2HTTALDH1A1
SCHEMBL4905129 0.87 MMP13 (0.52) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL4906333 0.80 NPC1 (0.48) KEAP1NFE2L2SMN1; SMN2ALDH1A1TDP1
SCHEMBL4905784 0.80 LMNA (0.47) KEAP1NFE2L2ATMSMN1; SMN2ALDH1A1
SCHEMBL4902970 0.79 KEAP1 (0.48) KEAP1NFE2L2ATMSMN1; SMN2KDM4E
SCHEMBL4902733 0.79 ESR1 (0.60) ATMSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL4903818 0.79 ESR1 (0.52) ATMSMN1; SMN2ALDH1A1LMNA
SCHEMBL4905993 0.78 LMNA (0.56) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL4904032 0.78 KEAP1 (0.49) KEAP1NFE2L2SMN1; SMN2ALDH1A1LMNA
SCHEMBL4895775 0.78 ALDH1A1 (0.48) SMN1; SMN2HTTALDH1A1LMNAKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 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 (2 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD KEAP1 714/4885NFE2L2 451/4885ATM 1568/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD KEAP1 810/4885NFE2L2 446/4885ATM 1692/4885

“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.