SCHEMBL7960699

SCHEMBL7960699

Cc1ccc(-c2n[nH]c(-c3nc4cc(C(=N)N)ccc4[nH]3)c2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.67
F9 P00740 4/20 0.67
F7 P08709 4/20 0.67
F11 P03951 3/20 0.67
F2 P00734 7/20 0.48
PLAU P00749 7/20 0.48
PRSS1 P07477 7/20 0.48
PLG P00747 6/20 0.48
PLAT P00750 4/20 0.48
KLKB1 P03952 1/20 0.44
CHEK2 O96017 1/20 0.43
MAPK1 P28482 1/20 0.41
MAP2K4 P45985 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
MAPKAPK3 Q16644 1/20 0.41
MAPK6 Q16659 1/20 0.41
MAPKAPK5 Q8IW41 1/20 0.41

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
SCHEMBL20307774 0.89 F10 (0.67) F10F9F7F11F2
SCHEMBL7969187 0.89 F10 (0.67) F10F9F7F11F2
SCHEMBL7973134 0.89 F10 (0.64) F10F9F7F11F2
SCHEMBL7976836 0.88 F10 (0.54) F10F9F7F11F2
SCHEMBL1232343 0.82 F10 (0.84) F10F9F7F11F2
SCHEMBL20307797 0.82 F9 (0.47) F10F9F7F11CHEK2
SCHEMBL7982567 0.81 F10 (0.58) F10F9F7F11F2
SCHEMBL10172686 0.81 CHEK2 (0.69) F10F9F7F11CHEK2
SCHEMBL7973887 0.81 F10 (0.70) F10F9F7F11F2
SCHEMBL7973776 0.81 F10 (1.00) F10F9F7F11F2

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-2009143039-A2 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS SCHERING CORPORATION (US) 2009-11-26 WO disclosed