SCHEMBL7903708

SCHEMBL7903708

N=C(N)c1ccc(NC(=O)[C@H](O)C2OCCN(c3cccc(OC(F)(F)F)c3)C2=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F9 P00740 13/20 0.71
F10 P00742 1/20 0.38
PRSS1 P07477 1/20 0.38
KLK1 P06870 1/20 0.38
KLK5 Q9Y337 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
SCHEMBL1947174 1.00 F9 (0.71) F9F10PRSS1KLK1KLK5
Hydrochloric Acid SCHEMBL1948474 0.99 F9 (0.70) F9F10PRSS1KLK1KLK5
SCHEMBL1945722 0.91 F9 (0.75) F9
Hydrochloric Acid SCHEMBL1947515 0.90 F9 (0.73) F9
SCHEMBL12545871 0.89 F9 (0.75) F9F10PRSS1
SCHEMBL12812976 0.89 F9 (0.59) F9
SCHEMBL1946983 0.88 F9 (0.73) F9KLK1KLK5
SCHEMBL1948965 0.87 F9 (0.77) F9F10PRSS1
SCHEMBL1947057 0.87 F9 (0.79) F9F10PRSS1
SCHEMBL1947691 0.87 F9 (0.71) F9F10PRSS1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed