SCHEMBL222217

SCHEMBL222217

CC(C)N1CCC(NS(=O)(=O)C[C@H](CO)NC(=O)c2ccc(Cl)s2)CC1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.69
SMN1; SMN2 Q16637 2/20 0.42
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
F2 P00734 1/20 0.37
KLK1 P06870 1/20 0.37

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
SCHEMBL3876352 0.85 F10 (0.55) F10F2KLK1
SCHEMBL220661 0.82 F10 (0.89) F10MAPK1
SCHEMBL219798 0.82 F10 (1.00) F10SMN1; SMN2MAPK1
SCHEMBL221783 0.81 F10 (0.71) F10SMN1; SMN2KMT2ALMNAMAPK1
SCHEMBL223513 0.80 F10 (0.68) F10SMN1; SMN2LMNAMAPK1
SCHEMBL219591 0.78 F10 (0.72) F10SMN1; SMN2KMT2ALMNAMAPK1
Fumaric Acid SCHEMBL221972 0.77 F10 (0.89) F10SMN1; SMN2MAPK1
SCHEMBL222580 0.76 F10 (0.66) F10LMNAF2
SCHEMBL222308 0.76 F10 (0.65) F10SMN1; SMN2LMNAMAPK1
SCHEMBL221322 0.74 F10 (0.66) F10LMNAMAPK1F2

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