SCHEMBL8423629

SCHEMBL8423629

COC(=O)C(NS(=O)(=O)c1ccc2ccc(OC)cc2c1)[C@@H]1CCN(Cc2csc(C#N)c2)C1=O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.55
F2 P00734 7/20 0.55
PLG P00747 2/20 0.49
PROC P04070 2/20 0.49
PLAT P00750 1/20 0.49
PRSS1 P07477 1/20 0.47
KLK6 Q92876 2/20 0.46

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
SCHEMBL8425839 0.94 F10 (0.55) F10F2PLGPROCPLAT
SCHEMBL8424687 0.94 F10 (0.52) F10F2PLGPROCPLAT
SCHEMBL8424713 0.89 F10 (0.50) F10F2PLGPROCPLAT
SCHEMBL8428253 0.88 F10 (0.49) F10F2PLGPROCPLAT
SCHEMBL2327156 0.84 F10 (0.73) F10F2PLGPROCPRSS1
SCHEMBL2330460 0.82 F10 (0.56) F10F2PLGPROCPLAT
SCHEMBL8423753 0.81 F10 (0.51) F10F2PLGPROCPLAT
SCHEMBL8423852 0.81 F10 (0.54) F10F2PLGPROCPLAT
SCHEMBL8425627 0.81 F10 (0.61) F10F2PLGPROCPLAT
SCHEMBL8425373 0.80 F10 (0.52) F10F2PLGPROCPRSS1

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-5958918-A Substituted (sulfinic acid, sulfonic acid, sulfonylamino or sulfinylamino) N- (aminominomethyl)phenylalkyl!-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. 1999-09-28 US disclosed