SCHEMBL4512796

SCHEMBL4512796

CC(C)(C)c1ccc(S(=O)(=O)NCCCc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.72
TP53 P04637 1/20 0.68
GAA P10253 1/20 0.68
LMNA P02545 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
HTT P42858 1/20 0.63
POLB P06746 2/20 0.56
TAAR1 Q96RJ0 1/20 0.55
HSD17B10 Q99714 1/20 0.55
PRMT1 Q99873 1/20 0.55
TDP1 Q9NUW8 1/20 0.54
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53
MAPT P10636 2/20 0.52

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
SCHEMBL12042482 0.91 ALDH1A1 (0.74) ALDH1A1LMNASMN1; SMN2HTTPOLB
SCHEMBL4517775 0.88 ALDH1A1 (0.67) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL1287345 0.86 ALDH1A1 (0.72) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL407477 0.85 ALDH1A1 (1.00) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL28808214 0.84 ALDH1A1 (0.79) ALDH1A1TP53GAAPOLBTAAR1
SCHEMBL4520992 0.82 ALDH1A1 (0.77) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL13959181 0.82 ALDH1A1 (0.67) ALDH1A1TP53GAAPOLBTAAR1
SCHEMBL13889021 0.82 ALDH1A1 (0.81) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL3913371 0.81 ALDH1A1 (0.79) ALDH1A1TP53GAALMNASMN1; SMN2
SCHEMBL1287271 0.81 ALDH1A1 (1.00) ALDH1A1TP53GAATAAR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093485-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2009-04-09 US disclosed
US-20090093485-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2009-04-09 US disclosed
US-20090093485-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2009-04-09 US disclosed
EP-1807391-A1 NOVEL SULPHONAMIDE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS FOR THE TREATMENT OF INFLAMMATORY DISEASES AstraZeneca AB (SE) 2007-07-18 EP disclosed
WO-2006046916-A1 NOVEL SULPHONAMIDE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS FOR THE TREATMENT OF INFLAMMATORY DISEASES ASTRAZENECA AB (SE) 2006-05-04 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-20090093485-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases NR3C1, NR3C2, NR5A1 ALDH1A1 2398/4885TP53 4786/4885GAA 3779/4885

“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.