SCHEMBL3407585

SCHEMBL3407585

Cc1c(N2CCCC2=O)cccc1S(=O)(=O)N[C@@H](C(N)=O)C(=O)N1CCN(C)CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.61
F10 P00742 8/20 0.61
F9 P00740 2/20 0.61
PLG P00747 2/20 0.61
PLAT P00750 2/20 0.61
KLKB1 P03952 2/20 0.61
PRSS1 P07477 2/20 0.61
PRSS2 P07478 2/20 0.61
PRSS3 P35030 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD11B1 P28845 1/20 0.35

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
Hydrochloric Acid SCHEMBL3401696 0.99 F2 (0.62) F2F10F9PLGPLAT
SCHEMBL12096037 0.97 F2 (0.58) F2F10F9PLGPLAT
SCHEMBL1771003 0.93 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL12096055 0.93 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL12096376 0.92 F2 (0.54) F2F10F9PLGPLAT
SCHEMBL12095827 0.91 F2 (0.52) F2F10F9PLGPLAT
SCHEMBL12096120 0.90 F2 (0.54) F2F10F9PLGPLAT
SCHEMBL12096012 0.90 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL12095867 0.90 F2 (0.51) F2F10F9PLGPLAT
SCHEMBL12095861 0.90 F2 (0.51) F2F10F9PLGPLAT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9637479-B2 Tartrate salt of 5-chloro-thiophene-2-carboxylic acid [(S)-2-[2-methyl-3-(2-oxo-pyrrolidin-1-yl)-benzenesulfonylamino]-3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]amide SANOFI (FR) 2017-05-02 US claimed
US-9637479-B2 Tartrate salt of 5-chloro-thiophene-2-carboxylic acid [(S)-2-[2-methyl-3-(2-oxo-pyrrolidin-1-yl)-benzenesulfonylamino]-3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]amide SANOFI (FR) 2017-05-02 US disclosed
US-9637479-B2 Tartrate salt of 5-chloro-thiophene-2-carboxylic acid [(S)-2-[2-methyl-3-(2-oxo-pyrrolidin-1-yl)-benzenesulfonylamino]-3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]amide SANOFI (FR) 2017-05-02 US disclosed
US-9637479-B2 Tartrate salt of 5-chloro-thiophene-2-carboxylic acid [(S)-2-[2-methyl-3-(2-oxo-pyrrolidin-1-yl)-benzenesulfonylamino]-3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]amide SANOFI (FR) 2017-05-02 US disclosed
US-8378092-B2 Chlorothiophene-amides as inhibitors of coagulation factors Xa and thrombin SANOFI (FR) 2013-02-19 US disclosed
EP-2254881-B1 CHLOROTHIOPHENE-AMIDES AS INHIBITORS OF COAGULATION FACTORS XA AND THROMBIN SANOFI SA (FR) 2012-09-12 EP disclosed
EP-2254881-A1 CHLOROTHIOPHENE-AMIDES AS INHIBITORS OF COAGULATION FACTORS XA AND THROMBIN Sanofi-Aventis (FR) 2010-12-01 EP disclosed
WO-2009103440-A1 CHLOROTHIOPHENE-AMIDES AS INHIBITORS OF COAGULATION FACTORS XA AND THROMBIN SANOFI-AVENTIS (FR) 2009-08-27 WO disclosed