SCHEMBL6978062

SCHEMBL6978062

CS(=O)(=O)N1C[C@H](C(=O)Nc2ccc(-c3ccccc3S(N)(=O)=O)cc2)[C@H](c2cccc(C(=N)N)c2)C1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.62
PRSS1 P07477 12/20 0.62
F2 P00734 1/20 0.56
PLG P00747 1/20 0.55
PROC P04070 1/20 0.55

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
SCHEMBL6982485 1.00 F10 (0.62) F10PRSS1F2PLGPROC
SCHEMBL6985029 0.91 F10 (0.51) F10PRSS1F2
SCHEMBL6978219 0.89 F10 (0.55) F10PRSS1F2
SCHEMBL6164332 0.86 F10 (0.62) F10PRSS1F2PLGPROC
SCHEMBL6166353 0.86 F10 (0.62) F10PRSS1F2PLGPROC
SCHEMBL6979556 0.85 F10 (0.67) F10PRSS1
SCHEMBL7494024 0.84 F10 (0.60) F10PRSS1F2PLGPROC
SCHEMBL6163514 0.82 F10 (0.54) F10PRSS1F2PLGPROC
SCHEMBL6979437 0.80 F10 (0.73) F10PRSS1
SCHEMBL6979424 0.80 F10 (0.51) F10PRSS1F2

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-0934265-B1 AMIDINOPHENYL-PYRROLIDINES, -PYRROLINES, AND -ISOXAZOLIDINES AND DERIVATIVES THEREOF BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-01-02 EP claimed