SCHEMBL2805040

SCHEMBL2805040

COc1cc(C(=O)NS(=O)(=O)c2ccccc2S(N)(=O)=O)ccc1C#Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.66
ACACB O00763 1/20 0.39
SLC16A3 O15427 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
BCL2L1 Q07817 1/20 0.37
MCL1 Q07820 1/20 0.37
CA2 P00918 2/20 0.37
MAPT P10636 2/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
CA1 P00915 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL2801667 0.90 PTGES (0.57) PTGESACACBTRPV1BCL2L1MCL1
SCHEMBL2803372 0.90 PTGES (0.69) PTGESSLC16A3GAAPKMCA2
SCHEMBL2802112 0.90 PTGES (0.74) PTGESSLC16A3GAAPKMMCL1
SCHEMBL2804931 0.89 PTGES (0.70) PTGESSLC16A3GAAPKMCA2
SCHEMBL2802222 0.88 PTGES (0.69) PTGESSLC16A3GAAPKMCA2
SCHEMBL2805760 0.86 PTGES (0.79) PTGESTRPV1CA2CA12CA9
SCHEMBL2804978 0.85 PTGES (0.68) PTGESSLC16A3GAAPKMCA2
SCHEMBL976927 0.85 PTGES (0.54) PTGESTRPV1BCL2L1MCL1PTGES2
SCHEMBL2804985 0.85 PTGES (0.70) PTGESSLC16A3GAAPKMCA2
SCHEMBL2802863 0.84 PTGES (0.61) PTGESTRPV1BCL2L1MCL1CA2

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 6 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
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 9/4885ACACB 2090/4885SLC16A3 1844/4885

“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.