SCHEMBL7367914

SCHEMBL7367914

COc1ccc2sc(Cc3ccc4c(c3)OOC4)c(S(=O)(=O)Nc3onc(C)c3Cl)c2c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.43
EDNRB P24530 14/20 0.43
ABCC3 O15438 1/20 0.36
ABCC4 O15439 1/20 0.36
ABCB11 O95342 1/20 0.36
PDE4A P27815 1/20 0.36

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
SCHEMBL4631489 0.87 EDNRA (0.53) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4631516 0.81 EDNRA (0.53) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4631462 0.75 EDNRA (0.53) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL6150865 0.75 EDNRA (0.54) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4663251 0.73 EDNRA (0.50) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL7158487 0.72 EDNRA (0.45) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL6152888 0.72 EDNRA (0.48) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL7524703 0.72 EDNRA (0.44) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL4631801 0.71 EDNRA (0.50) EDNRAEDNRBABCC3ABCC4ABCB11
SCHEMBL6151140 0.69 EDNRA (0.47) 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
EP-0819125-A1 THIENYL-, FURYL-, PYRROLYL- AND BIPHENYLSULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-01-21 EP disclosed
WO-1996031492-A1 THIENYL-, FURYL-, PYRROLYL- AND BIPHENYLSULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1996-10-10 WO disclosed