SCHEMBL7219972

SCHEMBL7219972

COc1nccnc1NS(=O)(=O)c1ccsc1C(=O)Cc1cc2c(cc1C)OOC2

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 18/20 0.53
▸ EDNRB P24530 17/20 0.53
▸ ABCC3 O15438 1/20 0.49
▸ ABCC4 O15439 1/20 0.49
▸ ABCB11 O95342 1/20 0.49
▸ PDE4A P27815 1/20 0.49
▸ GAA P10253 1/20 0.38
▸ CCR4 P51679 1/20 0.38

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
SCHEMBL7048101 0.88 EDNRA (0.68) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4907853 0.82 EDNRA (0.59) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4240721 0.79 EDNRA (0.79) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL3890891 0.77 EDNRA (0.53) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL7046595 0.71 EDNRA (0.59) EDNRAEDNRB
SCHEMBL4907860 0.69 EDNRA (0.75) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL6150890 0.69 EDNRA (1.00) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL7048930 0.69 EDNRA (0.53) EDNRAEDNRB
SCHEMBL7047483 0.69 EDNRA (0.54) EDNRAEDNRB
SCHEMBL7047487 0.68 EDNRA (0.48) EDNRAEDNRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6632829-B2 Thienyl, furyl and pyrrolyl-sulfonamides, useful for treating hypertension, cardiovascular disease, asthma, pulmonary hypertension, inflammatory diseases, vision defects, menstrual disorders, renal failure and other diseases TEXAS BIOTECHNOLOGY CORP. 2003-10-14 — — US claimed
EP-1342721-A1 Sulfonamides and derivatives thereof that modulate the activity of endothelin ENCYSIVE PHARMACEUTICALS INC. (US) 2003-09-10 — — EP claimed
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