SCHEMBL4516340

SCHEMBL4516340

COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)COc1ccc(Cl)cc1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
ALPL P05186 1/20 0.43
HPGD P15428 3/20 0.42
THRB P10828 1/20 0.42
MAPK1 P28482 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
RRM1 P23921 1/20 0.42
RRM2B Q7LG56 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 3/20 0.41
KCNMA1 Q12791 1/20 0.41
NR3C1 P04150 1/20 0.41

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
SCHEMBL4510480 0.94 ALPL (0.48) KMT2AALDH1A1SMN1; SMN2NPSR1ALPL
SCHEMBL4518235 0.93 ALDH1A1 (0.44) KMT2AALDH1A1MEN1SMN1; SMN2NPSR1
SCHEMBL4517562 0.89 WDR5 (0.50) ALDH1A1SMN1; SMN2NPSR1ALPLL3MBTL1
SCHEMBL4512653 0.85 MMP7 (0.46) ALDH1A1SMN1; SMN2NPSR1ALPLLMNA
SCHEMBL4515213 0.85 NR3C1 (0.55) KMT2AMEN1NR3C1
SCHEMBL4527510 0.83 AVPR1A (0.47) ALDH1A1NR3C1
SCHEMBL4515854 0.80 CHRM2 (0.40) CHRM2CHRM1RRM1RRM2BNR3C1
SCHEMBL13889065 0.80 NPSR1 (0.46) NPSR1L3MBTL1
SCHEMBL4515611 0.80 FLT1 (0.45) KMT2AALDH1A1SMN1; SMN2NPSR1LMNA
SCHEMBL13889060 0.80 FLT1 (0.45) KMT2AALDH1A1SMN1; SMN2NPSR1LMNA

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 KMT2A 3638/4885ALDH1A1 2398/4885MEN1 4535/4885

“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.