SCHEMBL8955008

SCHEMBL8955008

Nc1cccc(C[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCC2)c1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLG P00747 7/20 0.77
F10 P00742 3/20 0.77
PLAU P00749 2/20 0.77
F2 P00734 1/20 0.64
F12 P00748 1/20 0.63
KLKB1 P03952 1/20 0.63
PROC P04070 1/20 0.63

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
SCHEMBL9664214 0.84 POLB (0.58) PLGF10PLAUF2
SCHEMBL27489065 0.84 PLG (0.67) PLGF10PLAUF2
SCHEMBL8954841 0.83 F10 (0.59) PLGF10PLAUF2
SCHEMBL7439785 0.83 PLG (0.83) PLGF10PLAUF12KLKB1
Hydrochloric Acid SCHEMBL6793275 0.83 PLG (0.66) PLGF10PLAUF2
SCHEMBL6786044 0.81 F10 (0.63) PLGF10PLAUF2
SCHEMBL8721773 0.81 F10 (0.63) PLGF10PLAUF2
SCHEMBL8954654 0.80 F10 (0.59) PLGF10PLAUF2
SCHEMBL8954813 0.80 F10 (0.63) PLGF10PLAUF2
SCHEMBL8954934 0.80 F2 (0.76) PLGF10PLAUF2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5518735-A ANTICOAGULANTS ADMINISTERED BY MOUTH PENTAPHARM AG (CH) 1996-05-21 US disclosed
WO-1992008709-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES PENTAPHARM AG (CH) 1992-05-29 WO disclosed