SCHEMBL221271

SCHEMBL221271

O=C(NCCS(=O)(=O)NC1CCN(c2ccncc2)CC1)c1ccc(Cl)s1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.68
F2 P00734 2/20 0.44
MAPK1 P28482 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
SCHEMBL221386 0.83 F10 (0.74) F10F2MAPK1
SCHEMBL219798 0.81 F10 (1.00) F10MAPK1
SCHEMBL222335 0.78 F10 (0.67) F10MAPK1
Hydrochloric Acid SCHEMBL223131 0.77 F10 (0.66) F10MAPK1
Fumaric Acid SCHEMBL221972 0.77 F10 (0.89) F10MAPK1
SCHEMBL220661 0.76 F10 (0.89) F10MAPK1
SCHEMBL219792 0.75 F10 (0.81) F10MAPK1
SCHEMBL219902 0.73 KDM1A (0.42) F10
SCHEMBL221450 0.71 F10 (0.60) F10MAPK1
SCHEMBL3871671 0.71 ITGB3 (0.44) F10

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
US-8088925-B2 low molecular weight factor Xa specific blood clotting inhibitors; less side effects; 5-Chloro-thiophene-2-carboxylic acid [2-(1-isopropyl-piperidin-4-ylsulfamoyl)-ethyl]-amide; thromboembolic diseases or restenosis; antithrombotic agents SANOFI-AVENTIS (FR) 2012-01-03 US claimed
US-8088925-B2 low molecular weight factor Xa specific blood clotting inhibitors; less side effects; 5-Chloro-thiophene-2-carboxylic acid [2-(1-isopropyl-piperidin-4-ylsulfamoyl)-ethyl]-amide; thromboembolic diseases or restenosis; antithrombotic agents SANOFI-AVENTIS (FR) 2012-01-03 US disclosed