SCHEMBL2332558

SCHEMBL2332558

CN([C@H]1CCN(Cc2csc(C#N)c2)C1=O)S(=O)(=O)c1ccc2c(Cl)c(NC(=O)OCc3ccccc3)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.46
F2 P00734 10/20 0.46
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
PROC P04070 1/20 0.46
KLK6 Q92876 3/20 0.38
KMT2A Q03164 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
SCHEMBL2332931 0.92 F10 (0.44) F10F2PLGPLATPROC
SCHEMBL8425865 0.91 F10 (0.37) F10F2PLGPLATPROC
SCHEMBL2329743 0.90 F10 (0.46) F10F2PLGPLATPROC
SCHEMBL2327584 0.89 F10 (0.40) F10F2PLGPLATPROC
SCHEMBL2329425 0.88 F10 (0.52) F10F2PLGPLATPROC
SCHEMBL8425687 0.84 MGAT2 (0.35) F10F2PLGPROC
SCHEMBL8428420 0.82 F10 (0.33) F10F2
SCHEMBL2329089 0.81 F10 (0.40) F10F2PLGPLATPROC
SCHEMBL2325817 0.81 F10 (0.50) F10F2PLGPLATPROC
SCHEMBL2325807 0.80 F10 (0.50) F10F2PLGPLATPROC

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-0853618-B1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL -AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2011-08-17 EP disclosed