SCHEMBL8954706

SCHEMBL8954706

N=C(N)c1cccc(C[C@](N)(C(=O)N2CCC[C@H]2C(=O)O)S(=O)(=O)c2ccc3ccccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 15/20 0.52
▸ PLAU P00749 5/20 0.49
▸ PLG P00747 5/20 0.49
▸ PROC P04070 1/20 0.49
▸ ST14 Q9Y5Y6 3/20 0.48
▸ HPN P05981 1/20 0.48
▸ HGFAC Q04756 1/20 0.48
▸ F2 P00734 2/20 0.48

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
Hydrochloric Acid SCHEMBL8954922 0.97 F10 (0.51) F10PLAUPLGPROCST14
Iodide SCHEMBL9710508 0.89 F10 (0.51) F10PLAUPLGF2
SCHEMBL8954839 0.88 F10 (0.47) F10PLAUPLGPROCST14
SCHEMBL8954767 0.87 F10 (0.50) F10PLAUPLGPROCST14
Hydrochloric Acid SCHEMBL8954995 0.86 F10 (0.49) F10PLAUPLGPROCST14
SCHEMBL8954875 0.86 F10 (0.44) F10PLAUPLGST14F2
SCHEMBL8954783 0.85 F10 (0.49) F10PLAUPLGPROCST14
SCHEMBL8954880 0.85 F10 (0.52) F10PLAUPLGPROCST14
Iodide SCHEMBL8954868 0.84 F10 (0.51) F10PLAUPLGPROCST14
Bicarbonate SCHEMBL9665131 0.83 F10 (0.57) F10PLAUPLGF2

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
Send feedback