SCHEMBL222415

SCHEMBL222415

O=C(NCCS(=O)(=O)NN1CCN(Cc2ccccc2)CC1)c1ccc(Cl)s1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.51
MAPK1 P28482 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL3874864 0.84 LMNA (0.45) MAPK1SMN1; SMN2LMNAL3MBTL1KMT2A
SCHEMBL220752 0.72 SIGMAR1 (0.51) MAPK1SMN1; SMN2LMNAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL5358583 0.71 KMT2A (0.53) MAPK1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL3873216 0.70 MAPK1 (0.52) MAPK1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL222335 0.69 F10 (0.67) F10MAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL221423 0.69 ADRA1D (0.55)
SCHEMBL221386 0.69 F10 (0.74) F10MAPK1SMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL223131 0.68 F10 (0.66) F10MAPK1SMN1; SMN2LMNAKDM4E
SCHEMBL6345018 0.68 SIGMAR1 (0.60) MAPK1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL7774100 0.68 F10 (0.52) F10MAPK1HPGD

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