SCHEMBL3820871

SCHEMBL3820871

Cc1ccc2sc(C(=O)CS(=O)(=O)ONC(=N)N)cc2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 14/20 0.37
PLAU P00749 3/20 0.36
F9 P00740 3/20 0.35
ICAM1 P05362 2/20 0.34
SELE P16581 2/20 0.34
F10 P00742 1/20 0.32

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
SCHEMBL3821498 0.90 SLC9A1 (0.38) SLC9A1PLAUF9F10
SCHEMBL3818309 0.88 SLC9A1 (0.36) SLC9A1PLAUF9F10
SCHEMBL3813765 0.86 PLAU (0.54) SLC9A1PLAUF9F10
SCHEMBL3817293 0.85 SLC9A1 (0.37) SLC9A1PLAUF9F10
SCHEMBL3815869 0.83 SLC9A1 (0.52) SLC9A1PLAUF9F10
SCHEMBL3814870 0.81 SLC9A1 (0.47) SLC9A1PLAUF9
SCHEMBL3818017 0.80 SLC9A1 (0.55) SLC9A1PLAUF9F10
SCHEMBL3817053 0.80 PRP4K (0.39) SLC9A1PLAUF9F10
SCHEMBL3814353 0.80 SLC9A1 (0.51) SLC9A1PLAUF9F10
SCHEMBL3815060 0.80 SLC9A1 (0.56) SLC9A1PLAUF9F10

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-1831192-A4 BENZOTHIOPHEN-2-CARBONYLGUANIDINE DERIVATIVES, PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KOREA RES INST CHEM TECH (KR) 2009-08-19 EP disclosed
EP-1831192-A1 BENZOTHIOPHEN-2-CARBONYLGUANIDINE DERIVATIVES, PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Korea Research Institute of Chemical Technology (KR) 2007-09-12 EP disclosed
WO-2006071047-A1 BENZOTHIOPHEN-2-CARBONYLGUANIDINE DERIVATIVES, PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-07-06 WO disclosed