SCHEMBL7858770

SCHEMBL7858770

Cc1noc(NS(=O)(=O)c2ccccc2Br)c1Cl

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 18/20 0.76
EDNRB P24530 13/20 0.76
BRD4 O60885 1/20 0.55

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
SCHEMBL7224337 0.86 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6640611 0.86 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6153676 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL24822153 0.81 EDNRA (0.65) EDNRAEDNRB
SCHEMBL30743777 0.81 EDNRA (0.65) EDNRAEDNRB
SCHEMBL7860458 0.80 EDNRA (0.79) EDNRAEDNRB
SCHEMBL7232444 0.80 EDNRA (1.00) EDNRAEDNRB
SCHEMBL9064490 0.80 EDNRA (1.00) EDNRAEDNRB
SCHEMBL30844573 0.78 EDNRA (0.56) EDNRAEDNRBBRD4
SCHEMBL5330400 0.78 EDNRA (0.56) EDNRAEDNRBBRD4

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-1069114-A2 Sulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 2001-01-17 EP claimed
US-6030991-A ADJUSTING THE BINDING OF AN ENDOTHELIN PEPTIDE TO ENDOTHELIN A OR, PARTICULARLY, ENDOTHELIN B RECEPTORS, I.E. INHIBITING OR STIMULATING; ANTIINFLAMMATORY AGENT; ASTHMA; KIDNEYS; GASTROINTESTINAL, CARDIOASCULAR DISORDERS; HYPOTENSIVE AGENTS TEXAS BIOTECHNOLOGY CORP. (US) 2000-02-29 US claimed
EP-0870764-A1 Sulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-10-14 EP claimed
EP-0699191-A1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1996-03-06 EP claimed
WO-1994027979-A1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN IMMUNOPHARMACEUTICS, INC. (US) 1994-12-08 WO claimed
EP-1069114-A2 Sulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 2001-01-17 EP disclosed