SCHEMBL8316183

SCHEMBL8316183

CCc1ccccc1S(=O)(=O)Nc1ccc2nonc2c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.45
▸ PTPN2 P17706 6/20 0.44
▸ PTPN1 P18031 6/20 0.44
▸ PTPN5 P54829 6/20 0.44
▸ HSPD1 P10809 2/20 0.44
▸ HSPE1 P61604 2/20 0.44
▸ POLB P06746 2/20 0.41
▸ GFER P55789 1/20 0.41
▸ PKM P14618 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NR1I2 O75469 1/20 0.40

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
SCHEMBL8311757 0.74 EDNRA (0.72) KMT2AMEN1KDM4EHPGD
SCHEMBL8315915 0.73 CDK2 (0.48) KMT2APTPN2PTPN1PTPN5MEN1
SCHEMBL8315672 0.73 ALDH1A1 (0.46) KMT2APTPN2PTPN1PTPN5MEN1
SCHEMBL8316197 0.70 SMN1; SMN2 (0.50) KMT2APTPN2PTPN1PTPN5HSPD1
SCHEMBL8313217 0.70 CDC7 (0.64) KMT2APTPN2PTPN1PTPN5HSPD1
SCHEMBL8313727 0.69 HSPD1 (0.59) KMT2APTPN2PTPN1PTPN5HSPD1
SCHEMBL8316242 0.69 SMN1; SMN2 (0.54) KMT2APOLBPKMMEN1MAPT
SCHEMBL9750345 0.68 GAA (0.54) KMT2APTPN2PTPN1PTPN5HSPD1
SCHEMBL13629415 0.68 MEN1 (0.57) KMT2APTPN2PTPN1PTPN5HSPD1
Benzoic Acid SCHEMBL28546974 0.67 TSHR (0.55) MAPTLMNAHPGDHTT

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
Send feedback