SCHEMBL8993773

SCHEMBL8993773

N=C(N)c1ccc(CC(C(=O)O)n2cccc(NS(=O)(=O)c3ccc4ccccc4c3)c2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 1/20 0.48
F10 P00742 8/20 0.47
F2 P00734 7/20 0.47
PRSS1 P07477 6/20 0.47
PRSS2 P07478 3/20 0.47
PRSS3 P35030 3/20 0.47
ST14 Q9Y5Y6 2/20 0.47
PLG P00747 5/20 0.46
PLAU P00749 1/20 0.45
HPN P05981 1/20 0.44

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
SCHEMBL8993742 0.90 PLG (0.49) SLC16A3F10F2PRSS1PRSS2
SCHEMBL9710389 0.76 F2 (0.70) F10F2ST14PLGPLAU
SCHEMBL8993791 0.75 F2 (0.63) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993790 0.73 F2 (0.66) F10F2PRSS1PRSS2PRSS3
SCHEMBL3057528 0.72 F2 (0.60) F10F2PLGPLAU
SCHEMBL3419341 0.72 F2 (0.60) F10F2PLGPLAU
SCHEMBL8823969 0.70 CA2 (0.56) F10F2PRSS1PLGPLAU
SCHEMBL7439785 0.70 PLG (0.83) F10PLGPLAU
Acetic Acid SCHEMBL6032662 0.69 F2 (0.52) F10F2PRSS1PRSS2PRSS3
SCHEMBL9710517 0.68 F2 (0.57) F10F2PLGPLAU

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-5489583-A FOR TREATING OR PREVENTING THROMBOSIS BASF AKTIENGESELLSCHAFT (DE) 1996-02-06 US disclosed