SCHEMBL1170175

SCHEMBL1170175

O=C(O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.74
TAS2R14 Q9NYV8 13/20 0.72
CXCR3 P49682 3/20 0.72
TAS2R8 Q9NYW2 1/20 0.72
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
CNR2 P34972 1/20 0.69
TRPM8 Q7Z2W7 2/20 0.64
MEP1B Q16820 1/20 0.63

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
SCHEMBL12863697 0.90 CXCR3 (0.69) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1278788 0.86 TAS2R14 (0.97) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1278616 0.84 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1169926 0.84 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1278846 0.84 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1169636 0.83 CXCR3 (1.00) PTGESTAS2R14CXCR3TAS2R8CNR2
SCHEMBL1279281 0.82 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1169654 0.82 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1279497 0.82 TAS2R14 (1.00) PTGESTAS2R14CXCR3TAS2R8MEN1
SCHEMBL1169679 0.82 TAS2R14 (0.78) PTGESTAS2R14CXCR3TAS2R8MEN1

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
US-20110028509-A1 Sulfonamides MERCK SERONO SA (CH) 2011-02-03 US disclosed
US-20110028509-A1 Sulfonamides MERCK SERONO SA (CH) 2011-02-03 US disclosed
US-20110028509-A1 Sulfonamides MERCK SERONO SA (CH) 2011-02-03 US disclosed
EP-2265575-A2 SULFONAMIDES Merck Serono S.A. (CH) 2010-12-29 EP disclosed
WO-2009124962-A2 SULFONAMIDES MERCK SERONO S.A. (CH) 2009-10-15 WO disclosed
WO-2009124962-A2 SULFONAMIDES MERCK SERONO S.A. (CH) 2009-10-15 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-20110028509-A1 Sulfonamides CXCR3, CXCR2, CXCR1 PTGES 746/4885TAS2R14 517/4885CXCR3 1/4885

“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.