SCHEMBL8102918

SCHEMBL8102918

Bc1cc(C(C)NC(=O)CC(=O)Nc2ccc(C(=N)N)cc2)ccc1OC1CCN(CC(=O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F7 P08709 19/20 0.43
F2 P00734 14/20 0.43
F10 P00742 2/20 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
SCHEMBL8102477 0.91 ITGB3 (0.42) F7F2F10
SCHEMBL861163 0.91 F7 (0.48) F7F2F10
SCHEMBL860992 0.89 F7 (0.43) F7F2F10
SCHEMBL860524 0.87 F7 (0.40) F7F2F10
SCHEMBL860738 0.85 F7 (0.41) F7F2F10
SCHEMBL860491 0.82 F7 (0.46) F7F2F10
SCHEMBL860456 0.81 F7 (0.41) F7F2F10
SCHEMBL860939 0.81 F7 (0.50) F7F2F10
SCHEMBL860380 0.80 F7 (0.49) F7F2F10
SCHEMBL861396 0.79 F10 (0.39) F7F2F10

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-2009007015-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2009-01-15 WO disclosed