SCHEMBL13406847

SCHEMBL13406847

COC1=NS(=O)(=O)N=C1Nc1cccc(S(=O)(=O)N(C)C)c1O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCR6 P51684 7/20 0.41
▸ CXCR2 P25025 3/20 0.37
▸ CXCR1 P25024 2/20 0.37
▸ POLB P06746 1/20 0.32
▸ HTT P42858 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MCL1 Q07820 1/20 0.30

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
SCHEMBL13947887 0.86 MAPT (0.39) CCR6CXCR2CXCR1
SCHEMBL13406871 0.83 HTR6 (0.40) POLBALDH1A1SMN1; SMN2
SCHEMBL13406852 0.81 SMN1; SMN2 (0.39) CXCR2POLBALDH1A1SMN1; SMN2
SCHEMBL13406331 0.80 CCR6 (0.49) CCR6
SCHEMBL13406850 0.80 CXCR2 (0.39) CCR6CXCR2CXCR1
SCHEMBL13406849 0.80 TSHR (0.40) ALDH1A1SMN1; SMN2
SCHEMBL13405715 0.79 CCR6 (0.43) CCR6CXCR2CXCR1
SCHEMBL13406144 0.78 CXCR2 (0.48) CCR6CXCR2CXCR1
SCHEMBL13405718 0.76 CCR6 (0.48) CCR6CXCR2CXCR1
SCHEMBL13947886 0.73 CXCR2 (0.41) CCR6CXCR2CXCR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691856-B2 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION (US) 2010-04-06 — — US disclosed
US-7691856-B2 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION (US) 2010-04-06 — — US disclosed
US-20070264230-A1 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION 2007-11-15 — — US disclosed
US-20070264230-A1 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION 2007-11-15 — — 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-20070264230-A1 Thiadiazoledioxides and thiadiazoleoxides as CXC- and CC-chemokine receptor ligands CXCR1, CCR2, CX3CR1 CCR6 24/4885CXCR2 6/4885CXCR1 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.

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