SCHEMBL8954880

SCHEMBL8954880

N=C(N)c1cccc(C[C@](N)(C(=O)N2CCC(C(=O)O)C3CCCCC32)S(=O)(=O)c2ccc3ccccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 14/20 0.52
▸ PLG P00747 8/20 0.46
▸ PROC P04070 1/20 0.46
▸ ST14 Q9Y5Y6 4/20 0.46
▸ HPN P05981 1/20 0.46
▸ HGFAC Q04756 1/20 0.46
▸ PLAU P00749 5/20 0.45
▸ F2 P00734 3/20 0.45

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
Iodide SCHEMBL8954868 0.99 F10 (0.51) F10PLGPROCST14HPN
SCHEMBL8954816 0.90 F10 (0.39) F10PLGF2
SCHEMBL9664145 0.89 F10 (0.50) F10PLGPROCST14HPN
SCHEMBL8954679 0.89 F10 (0.43) F10PLGPROCST14HPN
Iodide SCHEMBL9666229 0.88 F10 (0.49) F10PLGPROCST14HPN
SCHEMBL8954682 0.86 ALOX5AP (0.38) F10F2
Hydrochloric Acid SCHEMBL8954922 0.85 F10 (0.51) F10PLGPROCST14HPN
SCHEMBL8954706 0.85 F10 (0.52) F10PLGPROCST14HPN
SCHEMBL8954584 0.85 F10 (0.39) F10PLGST14PLAUF2
SCHEMBL8954767 0.82 F10 (0.50) F10PLGPROCST14HPN

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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