SCHEMBL5559976

SCHEMBL5559976

Cc1cc(N)c2cc(NC(=O)c3ccc(CNC(=O)Oc4cnccn4)cc3)ccc2n1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.53
MMP1 P03956 3/20 0.52
OPRM1 P35372 8/20 0.49
OPRK1 P41145 8/20 0.49
OPRL1 P41146 8/20 0.49

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
SCHEMBL3240104 0.86 MMP9 (0.56) MMP9MMP1
SCHEMBL5559059 0.84 MMP9 (0.51) MMP9MMP1OPRM1OPRK1OPRL1
SCHEMBL3236312 0.82 MMP9 (0.58) MMP9MMP1OPRL1
SCHEMBL3240190 0.77 MMP9 (0.65) MMP9MMP1OPRL1
SCHEMBL3233136 0.76 MMP9 (0.51) MMP9MMP1
SCHEMBL3237638 0.76 CTNNB1 (0.54) MMP9MMP1
SCHEMBL3241861 0.75 CTNNB1 (0.55) MMP9MMP1
SCHEMBL3238075 0.74 MMP9 (0.56) MMP9MMP1
SCHEMBL5553600 0.73 MMP9 (0.70) MMP9MMP1OPRL1
SCHEMBL8359448 0.73 MMP9 (0.73) MMP9MMP1OPRL1

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
EP-1509516-B1 INHIBITORS OF THE GPIB -VWF INTERACTION, THEIR PREPARATION AND USE SANOFI AVENTIS DEUTSCHLAND (DE) 2007-01-31 EP claimed