SCHEMBL8623632

SCHEMBL8623632

N#Cc1cc(CN2CC[C@H](NS(=O)(=O)c3cc4ccc(Cl)cc4s3)C2=O)ccc1N

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.56
F2 P00734 5/20 0.49
PRSS1 P07477 4/20 0.49
PROC P04070 3/20 0.49
PLG P00747 2/20 0.49
PLAT P00750 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
SCHEMBL7538116 0.82 F10 (0.61) F10F2PRSS1PROCPLG
SCHEMBL8626495 0.81 F10 (0.46) F10F2PRSS1PROCPLG
SCHEMBL6221164 0.80 F10 (0.67) F10F2PRSS1PROCPLG
SCHEMBL7539268 0.80 F10 (0.63) F10F2PRSS1PROCPLG
Trifluoroacetic Acid SCHEMBL7374549 0.79 F10 (0.56) F10F2PRSS1PROCPLG
Trifluoroacetic Acid SCHEMBL7505792 0.76 F10 (0.67) F10F2PRSS1PROCPLG
Trifluoroacetic Acid SCHEMBL7507464 0.76 F10 (0.60) F10F2PRSS1PROCPLG
SCHEMBL7214244 0.76 F10 (0.65) F10F2PRSS1PROCPLG
Trifluoroacetic Acid SCHEMBL7538294 0.75 F10 (0.60) F10F2PRSS1PROCPLG
Trifluoroacetic Acid SCHEMBL7536908 0.75 F10 (0.56) F10F2PRSS1PROCPLG

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-5731315-A Substituted sulfonic acid n- (aminoiminomethyl)phenylalkyl!-azaheterocyclamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-03-24 US disclosed