SCHEMBL12095931

SCHEMBL12095931

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

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 0.51
F10 P00742 8/20 0.51
F9 P00740 2/20 0.51
PLG P00747 2/20 0.51
PLAT P00750 2/20 0.51
KLKB1 P03952 2/20 0.51
PRSS1 P07477 2/20 0.51
PRSS2 P07478 2/20 0.51
PRSS3 P35030 2/20 0.51
TSHR P16473 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL12095910 0.90 F2 (0.51) F2F10F9PLGPLAT
SCHEMBL12096281 0.90 F2 (0.52) F2F10F9PLGPLAT
SCHEMBL12096012 0.90 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL12095933 0.89 F2 (0.55) F2F10F9PLGPLAT
SCHEMBL14693608 0.89 F2 (0.51) F2F10F9PLGPLAT
SCHEMBL12096120 0.88 F2 (0.54) F2F10F9PLGPLAT
SCHEMBL1771003 0.88 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL12095938 0.87 F2 (0.40) F2F10F9PLGPLAT
SCHEMBL12096055 0.87 F2 (0.53) F2F10F9PLGPLAT
SCHEMBL3407585 0.87 F2 (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254881-B1 CHLOROTHIOPHENE-AMIDES AS INHIBITORS OF COAGULATION FACTORS XA AND THROMBIN SANOFI SA (FR) 2012-09-12 EP disclosed