SCHEMBL220902

SCHEMBL220902

CCCN(C(=O)NS(=O)(=O)CCNC(=O)c1ccc(Cl)s1)C1CCN(C(C)C)CC1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.66
MAPK1 P28482 1/20 0.42
TP53 P04637 1/20 0.41
ALDH1A1 P00352 1/20 0.38
UBE2M P61081 4/20 0.37
DCUN1D1 Q96GG9 4/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3873008 0.87 F10 (0.49) F10TP53ALDH1A1UBE2MDCUN1D1
SCHEMBL2737094 0.81 F10 (0.63) F10MAPK1TP53SMN1; SMN2
SCHEMBL221193 0.80 F10 (0.69) F10MAPK1SMN1; SMN2
SCHEMBL219798 0.80 F10 (1.00) F10MAPK1SMN1; SMN2
SCHEMBL219860 0.79 F10 (0.65) F10MAPK1TP53SMN1; SMN2
SCHEMBL220475 0.79 F10 (0.67) F10MAPK1SMN1; SMN2
SCHEMBL222611 0.78 F10 (0.66) F10MAPK1SMN1; SMN2
SCHEMBL221417 0.78 F10 (0.63) F10MAPK1ALDH1A1SMN1; SMN2
SCHEMBL221251 0.78 F10 (0.63) F10MAPK1SMN1; SMN2
SCHEMBL219872 0.76 F10 (0.63) F10MAPK1SMN1; SMN2

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