SCHEMBL8954753

SCHEMBL8954753

N=C(N)c1cccc(C[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N(CCC(=O)O)C2CCCCC2)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.65
▸ F10 P00742 10/20 0.64
▸ PLG P00747 4/20 0.64
▸ PLAU P00749 4/20 0.64
▸ ST14 Q9Y5Y6 2/20 0.61
▸ HPN P05981 1/20 0.61
▸ HGFAC Q04756 1/20 0.61

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
SCHEMBL9665995 0.83 PLG (0.74) F2F10PLGPLAUST14
SCHEMBL8954699 0.83 PLG (0.74) F2F10PLGPLAUST14
SCHEMBL8954805 0.81 PLG (0.66) F10PLGPLAUHPN
Hydrochloric Acid SCHEMBL8954613 0.80 PLG (0.65) F10PLGPLAUHPN
SCHEMBL8954725 0.80 F10 (0.58) F2F10PLGPLAUST14
Hydrochloric Acid SCHEMBL8954777 0.80 F10 (0.57) F2F10PLGPLAUST14
SCHEMBL8954760 0.79 F10 (0.48) F2F10PLGPLAUST14
SCHEMBL8954670 0.78 PLG (0.59) F2F10PLGPLAUST14
SCHEMBL30583119 0.78 F10 (0.76) F2F10PLGPLAUST14
SCHEMBL8954846 0.77 F10 (0.54) F2F10PLGPLAUST14

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-5518735-A ANTICOAGULANTS ADMINISTERED BY MOUTH PENTAPHARM AG (CH) 1996-05-21 — — US disclosed
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