SCHEMBL8040092

SCHEMBL8040092

N=C(N)c1ccc(OC(=O)C(F)(F)F)c(O)c1C(=O)N1CC[C@H](NS(=O)(=O)c2cc3nc(Cl)ccc3s2)C1=O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.52
F2 P00734 10/20 0.52
PROC P04070 8/20 0.52
PLG P00747 7/20 0.52
PLAT P00750 6/20 0.52
PRSS1 P07477 5/20 0.52

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
SCHEMBL7473709 0.85 F10 (0.62) F10F2PROCPLGPLAT
SCHEMBL7567382 0.78 F10 (0.67) F10F2PROCPLGPLAT
SCHEMBL7486473 0.78 F10 (0.66) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7473699 0.76 F10 (0.68) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7567372 0.76 F10 (0.68) F10F2PROCPLGPLAT
SCHEMBL8626132 0.76 F10 (0.54) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7486463 0.75 F10 (0.68) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7476266 0.72 F10 (0.89) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7477888 0.71 F10 (0.89) F10F2PROCPLGPLAT
Trifluoroacetic Acid SCHEMBL7477898 0.71 F10 (0.89) F10F2PROCPLGPLAT

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
US-6034093-A Substituted sulfonic acid N-[(aminoiminomethyl)phenylalkyl]-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-03-07 US disclosed