SCHEMBL8954679

SCHEMBL8954679

N=C(N)Nc1cccc(C[C@](N)(C(=O)N2CCC(C(=O)O)C3CCCCC32)S(=O)(=O)c2ccc3ccccc3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 11/20 0.43
▸ PLG P00747 7/20 0.37
▸ F2 P00734 7/20 0.37
▸ PLAU P00749 5/20 0.37
▸ ST14 Q9Y5Y6 4/20 0.37
▸ HPN P05981 1/20 0.36
▸ HGFAC Q04756 1/20 0.36
▸ PROC P04070 1/20 0.36
▸ PRSS1 P07477 1/20 0.35
▸ PRSS2 P07478 1/20 0.35
▸ PRSS3 P35030 1/20 0.35

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
SCHEMBL8954584 0.92 F10 (0.39) F10PLGF2PLAUST14
SCHEMBL9666086 0.89 F10 (0.42) F10PLGF2PLAUST14
SCHEMBL8954880 0.89 F10 (0.52) F10PLGF2PLAUST14
Iodide SCHEMBL8954868 0.88 F10 (0.51) F10PLGF2PLAUST14
SCHEMBL8954816 0.88 F10 (0.39) F10PLGF2
SCHEMBL8954875 0.87 F10 (0.44) F10PLGF2PLAUST14
SCHEMBL8954624 0.86 F10 (0.41) F10PLGF2PLAUST14
SCHEMBL8954682 0.84 ALOX5AP (0.38) F10F2PRSS1
SCHEMBL8955038 0.83 F10 (0.47) F10PLGF2PLAUST14
SCHEMBL8954856 0.83 F10 (0.50) F10PLGF2PLAUST14

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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