SCHEMBL10420196

SCHEMBL10420196

CCCCN(C(=O)CNS(=O)(=O)c1ccc2ccccc2c1)[C@@H](Cc1ccc(C(=N)N)cc1)C(=O)N1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.54
F2 P00734 4/20 0.54
PRSS1 P07477 3/20 0.54
PLG P00747 6/20 0.52
PLAU P00749 1/20 0.52
HPN P05981 1/20 0.47
ST14 Q9Y5Y6 1/20 0.47

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
SCHEMBL29514928 0.80 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL9189122 0.80 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL8743770 0.80 F10 (0.55) F10F2PRSS1PLGPLAU
SCHEMBL8144360 0.80 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL29651383 0.80 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL872422 0.80 PLG (0.67) F10F2PRSS1PLGPLAU
SCHEMBL7439785 0.77 PLG (0.83) F10PLGPLAU
SCHEMBL10358239 0.75 F10 (0.56) F10F2PRSS1PLGPLAU
SCHEMBL6797602 0.73 F10 (0.48) F10F2PRSS1PLGPLAU
SCHEMBL10357664 0.72 F10 (0.57) F10F2PRSS1PLGPLAU

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-4977168-A Derivatives of the N α-arylsulphonylaminoacyl-p-amidinophenyl-alaninamides, and their use as medicaments SANOFI (FR) 1990-12-11 US claimed