SCHEMBL2801488

SCHEMBL2801488

COC(C)(C)CCOc1cc(C(=O)NS(=O)(=O)c2ccccc2S(N)(=O)=O)ccc1C#CC1CC1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.75
CYSLTR1 Q9Y271 6/20 0.33
CYSLTR2 Q9NS75 4/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
PLA2G4A P47712 1/20 0.32
EPHX2 P34913 2/20 0.32
PPARG P37231 2/20 0.32

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
SCHEMBL979488 0.90 PTGES (0.72) PTGESEPHX2
SCHEMBL2804908 0.87 PTGES (0.67) PTGESCYSLTR1CYSLTR2PDE4APDE4B
SCHEMBL976770 0.86 PTGES (1.00) PTGESCYSLTR1CYSLTR2PDE4APDE4B
SCHEMBL13075603 0.85 PTGES (0.55) PTGESCYSLTR1CYSLTR2PDE4APDE4B
SCHEMBL2806373 0.85 PTGES (0.66) PTGESCYSLTR1CYSLTR2PDE4APDE4B
SCHEMBL979430 0.82 PTGES (0.50) PTGESCYSLTR1CYSLTR2
SCHEMBL2803224 0.82 PTGES (0.67) PTGESCYSLTR1CYSLTR2PDE4APDE4B
SCHEMBL979144 0.82 PTGES (0.81) PTGESCYSLTR1CYSLTR2PLA2G4A
SCHEMBL2801664 0.82 PTGES (0.64) PTGESCYSLTR1CYSLTR2PLA2G4AEPHX2
SCHEMBL2805700 0.80 PTGES (0.69) PTGESCYSLTR1CYSLTR2PDE4APDE4B

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
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO claimed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US claimed
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 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 (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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy PTGER1, SULT2A1, SULT1E1 PTGES 9/4885CYSLTR1 132/4885CYSLTR2 255/4885

“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.