SCHEMBL7339659

SCHEMBL7339659

COC(=O)C1=C(OS(=O)(=O)C(F)(F)F)c2ccccc2S(=O)(=O)N1Cc1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.54
POLB P06746 3/20 0.47
TSHR P16473 1/20 0.44
MAPT P10636 8/20 0.43
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ELANE P08246 1/20 0.39

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
SCHEMBL7342790 0.89 HSD11B1 (0.58) HSD11B1POLBMAPTCA12CA9
SCHEMBL7336277 0.86 HSD11B1 (0.48) HSD11B1POLBMAPTTP53SMN1; SMN2
SCHEMBL7828653 0.85 HSD11B1 (0.48) HSD11B1POLBTSHRMAPTCA12
SCHEMBL7335669 0.85 HSD11B1 (0.54) HSD11B1POLBMAPTTP53
SCHEMBL7343733 0.82 HSD11B1 (0.57) HSD11B1POLBMAPTTP53
SCHEMBL6542769 0.82 HSD11B1 (0.49) HSD11B1POLBMAPTTP53SMN1; SMN2
SCHEMBL7336087 0.81 HSD11B1 (0.52) HSD11B1POLBMAPTTP53SMN1; SMN2
SCHEMBL7334097 0.80 HSD11B1 (0.49) HSD11B1POLBTSHRMAPTTP53
SCHEMBL6542054 0.80 HSD11B1 (0.52) HSD11B1POLBMAPTTP53
SCHEMBL7334969 0.80 HSD11B1 (0.55) HSD11B1POLBMAPTTP53SMN1; SMN2

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
EP-0811001-B1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER LAMBERT CO (US) 2001-10-31 EP claimed
EP-0811001-A1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-12-10 EP claimed
WO-1996026195-A1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-08-29 WO claimed
EP-0811001-B1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER LAMBERT CO (US) 2001-10-31 EP disclosed
EP-0811001-A1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-12-10 EP disclosed
WO-1996026195-A1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-08-29 WO disclosed