SCHEMBL8659102

SCHEMBL8659102

Cc1ccc(-c2c(Cl)nc(-c3ccccc3)nc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 3/20 0.49
HSD17B2 P37059 1/20 0.45
EDNRB P24530 2/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HMOX1 P09601 1/20 0.44
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
PTGS2 P35354 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL9493302 0.89 EDNRA (0.51) EDNRAEDNRBKDM4EALDH1A1
SCHEMBL8657212 0.85 EDNRA (0.46) EDNRAEDNRBKDM4E
SCHEMBL7815226 0.82 EDNRA (0.50) EDNRAHSD17B2EDNRB
SCHEMBL8656735 0.82 EDNRA (0.70) EDNRAEDNRB
SCHEMBL8802241 0.81 EDNRA (0.52) EDNRAHSD17B2EDNRBMEN1KMT2A
SCHEMBL7197121 0.81 HSD17B2 (0.44) EDNRAHSD17B2MEN1KMT2AKDM4E
SCHEMBL6785011 0.79 EDNRA (0.67) EDNRAEDNRBMEN1KMT2AKDM4E
SCHEMBL7293882 0.76 EDNRA (0.72) EDNRAEDNRB
SCHEMBL8660654 0.72 LMNA (0.58) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL9044409 0.72 ALDH1A1 (0.55) EDNRAEDNRBMEN1KMT2AMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5728706-A ENDOTHELIN ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 1998-03-17 US disclosed
EP-0658548-B1 Benzenesulfonamide derivative and process for preparing thereof TANABE SEIYAKU CO (JP) 1997-11-19 EP disclosed
US-5589478-A ENDOTHELIN ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 1996-12-31 US disclosed
EP-0658548-A1 Benzenesulfonamide derivative and process for preparing thereof TANABE SEIYAKU CO., LTD. (JP) 1995-06-21 EP disclosed