SCHEMBL8102225

SCHEMBL8102225

CC(NC(=O)CC(=O)Nc1ccc(C(=N)N)cc1)c1ccc(CC2CCNCC2)c(-c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.53
F2 P00734 11/20 0.53
F10 P00742 2/20 0.46

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
SCHEMBL861397 0.87 F7 (0.51) F7F2F10
SCHEMBL860995 0.85 F7 (0.52) F7F2F10
SCHEMBL8095924 0.81 F7 (0.50) F7F2F10
SCHEMBL860428 0.79 F7 (0.79) F7F2F10
SCHEMBL860490 0.76 F7 (0.53) F7F2F10
Trifluoroacetic Acid SCHEMBL841989 0.76 F7 (0.71) F7F2F10
SCHEMBL860244 0.75 F7 (0.65) F7F2F10
SCHEMBL860992 0.74 F7 (0.43) F7F2F10
SCHEMBL14647037 0.74 F7 (0.51) F7F2F10
SCHEMBL860708 0.73 F7 (0.50) 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