SCHEMBL1948069

SCHEMBL1948069

COc1cc(C)c(S(=O)(=O)NCc2c(-c3ccccc3)noc2C)c(C)c1C

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.66
PKM P14618 4/20 0.66
NPSR1 Q6W5P4 1/20 0.62
TDP1 Q9NUW8 1/20 0.57
F2 P00734 2/20 0.50
NR3C1 P04150 2/20 0.46
PGR P06401 1/20 0.46
NR3C2 P08235 2/20 0.45
BRD4 O60885 1/20 0.45
BRD2 P25440 1/20 0.45
BRD3 Q15059 1/20 0.45
NMT1 P30419 1/20 0.44
GABRA5 P31644 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL1945818 0.84 ALDH1A1 (0.72) ALDH1A1PKMNPSR1TDP1NR3C1
SCHEMBL16502981 0.78 F2 (0.68) ALDH1A1PKMF2NMT1
SCHEMBL1948484 0.76 ALDH1A1 (0.90) ALDH1A1PKMNPSR1TDP1NR3C1
SCHEMBL1948067 0.73 ALDH1A1 (0.76) ALDH1A1PKMNPSR1TDP1GABRA5
SCHEMBL1946242 0.71 ALDH1A1 (0.80) ALDH1A1PKMNPSR1TDP1NR3C1
SCHEMBL1948804 0.70 ALDH1A1 (0.73) ALDH1A1PKMNPSR1TDP1GABRA5
SCHEMBL4516501 0.70 F2 (0.55) PKMTDP1F2NR3C1PGR
SCHEMBL1946175 0.70 ALDH1A1 (0.72) ALDH1A1PKMNPSR1TDP1PGR
SCHEMBL16502966 0.70 NMT1 (0.69) ALDH1A1PKMF2NMT1KDM4E
SCHEMBL16509564 0.69 NMT1 (0.62) ALDH1A1NPSR1F2BRD4BRD2

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-20110130426-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2011-06-02 US disclosed
US-20110130426-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2011-06-02 US disclosed
US-20110130426-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases ASTRAZENECA AB (SE) 2011-06-02 US disclosed
EP-1807405-A1 NOVEL SULPHONAMIDE DERIVATIVES AS GLUCOCORTICOID RECEPTOR MODULATORS FOR THE TREATMENT OF INFLAMMATORY DISEASES AstraZeneca AB (SE) 2007-07-18 EP disclosed
WO-2006046914-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-20110130426-A1 Novel Sulphonamide Derivatives as Glucocorticoid Receptor Modulators for the Treatment of Inflammatory Diseases NR3C1, NR3C2, NR5A1 ALDH1A1 2813/4885PKM 2418/4885NPSR1 225/4885

“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.