SCHEMBL8313917

SCHEMBL8313917

Nc1cccc(S(=O)(=O)Nc2ccc3nsnc3c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.58
▸ PKM P14618 2/20 0.58
▸ HSPD1 P10809 2/20 0.56
▸ HSPE1 P61604 2/20 0.56
▸ HTR6 P50406 2/20 0.55
▸ PTPN2 P17706 1/20 0.52
▸ PTPN1 P18031 1/20 0.52
▸ PTPN5 P54829 1/20 0.52
▸ KMT2A Q03164 1/20 0.51
▸ EDNRA P25101 1/20 0.51
▸ PIK3CD O00329 1/20 0.49
▸ PIK3CA P42336 1/20 0.49
▸ PIK3CB P42338 1/20 0.49
▸ PIK3CG P48736 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CDC7 O00311 1/20 0.47
▸ EEF2K O00418 1/20 0.47
▸ PLK4 O00444 1/20 0.47

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
SCHEMBL6760774 0.85 CDC7 (0.64) HSPD1HSPE1HTR6PTPN2PTPN1
SCHEMBL8541050 0.84 PIK3CD (0.57) PKMHSPD1HSPE1HTR6PTPN2
SCHEMBL8313727 0.81 HSPD1 (0.59) POLBPKMHSPD1HSPE1HTR6
SCHEMBL8313260 0.80 L3MBTL1 (0.64) HSPD1HSPE1PTPN2PTPN1PTPN5
SCHEMBL28271796 0.79 HTR6 (0.83) POLBPKMHSPD1HSPE1HTR6
SCHEMBL8317574 0.77 PIK3CD (0.54) PKMHSPD1HSPE1PTPN2PTPN1
SCHEMBL6764847 0.76 PIK3CD (0.68) HSPD1HSPE1PTPN2PTPN1PTPN5
SCHEMBL31702160 0.75 HSPD1 (0.61) POLBPKMHSPD1HSPE1HTR6
SCHEMBL3973555 0.75 POLB (1.00) POLBPKMHTR6KMT2AALDH1A1
SCHEMBL14093757 0.74 POLB (0.73) POLBPKMHTR6KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733626-B1 N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists MERCK PATENT GMBH (DE) 1999-01-13 — — EP disclosed
US-5726194-A Endothelin receptor antagonists MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-03-10 — — US disclosed
EP-0733626-A1 N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists MERCK PATENT GmbH (DE) 1996-09-25 — — EP disclosed
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