SCHEMBL7857285

SCHEMBL7857285

Cc1noc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 16/20 1.00
EDNRB P24530 12/20 1.00
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
POLB P06746 1/20 0.71
MAPT P10636 1/20 0.71
P2RY1 P47900 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
CYP2C9 P11712 1/20 0.64
TSHR P16473 1/20 0.64
CYP2C19 P33261 1/20 0.64
ADRA1A P35348 1/20 0.64

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
SCHEMBL7224492 0.86 EDNRB (1.00) EDNRAEDNRB
SCHEMBL7857530 0.84 EDNRA (1.00) EDNRAEDNRBMEN1KMT2AP2RY1
SCHEMBL7857604 0.83 EDNRA (0.76) EDNRAEDNRBMEN1KMT2ACYP2C9
SCHEMBL7856711 0.78 EDNRA (1.00) EDNRAEDNRBMEN1KMT2APOLB
SCHEMBL7860467 0.78 EDNRA (1.00) EDNRAEDNRBMEN1KMT2AMAPT
SCHEMBL7849834 0.78 EDNRA (0.78) EDNRAEDNRBMEN1KMT2AP2RY1
Sulfisoxazole SCHEMBL23467 0.78 EDNRA (1.00) EDNRAEDNRBMEN1KMT2ACYP2C9
Sulfisoxazole SCHEMBL788644 0.78 EDNRA (1.00) EDNRAEDNRBMEN1KMT2ACYP2C9
SCHEMBL7716850 0.78 EDNRA (1.00) EDNRAEDNRBMEN1KMT2ACYP2C9
SCHEMBL13284801 0.77 EDNRA (0.67) EDNRAEDNRBMEN1KMT2ACYP2C9

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 5 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
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