SCHEMBL7901577

SCHEMBL7901577

N=C(N)c1ccc(NC(=O)[C@H](O)[C@H]2OCCN(c3ccccc3O)C2=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F9 P00740 11/20 0.70
F2 P00734 6/20 0.45
F10 P00742 3/20 0.45
PLAU P00749 3/20 0.45
PLG P00747 2/20 0.45
PLAT P00750 2/20 0.45
KLK1 P06870 1/20 0.42
KLK5 Q9Y337 1/20 0.42
HPN P05981 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38

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
SCHEMBL1948970 0.91 F9 (0.68) F9F2F10PLAUPLG
SCHEMBL12545890 0.88 F9 (0.82) F9F2F10PLAUPLG
SCHEMBL1947953 0.88 F9 (0.68) F9F2F10KLK1KLK5
SCHEMBL1950503 0.88 F9 (0.67) F9F2F10PLAUPLG
SCHEMBL17237641 0.88 F9 (0.68) F9F2F10PLAUPLG
SCHEMBL12547899 0.88 F9 (0.67) F9F2F10PLAUPLG
SCHEMBL17237644 0.87 F9 (0.67) F9F2F10PLAUPLG
SCHEMBL1947490 0.87 F9 (0.63) F9F2F10PLAUPLG
SCHEMBL1948534 0.87 F9 (0.66) F9F2F10PLAUPLG
SCHEMBL1947068 0.86 F9 (0.62) F9F2F10KLK1KLK5

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
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed