SCHEMBL8190893

SCHEMBL8190893

C=C(O)c1cccc(=O)[nH]1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.47
MMP12 P39900 18/20 0.47
MMP9 P14780 16/20 0.47
MMP2 P08253 13/20 0.47
NOTUM Q6P988 1/20 0.43

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
SCHEMBL416800 0.79 MMP1 (0.53) MMP1MMP12MMP9MMP2
SCHEMBL17261572 0.74 MMP1 (0.53) MMP1MMP12MMP9MMP2NOTUM
SCHEMBL20206904 0.73 MMP1 (0.56) MMP1MMP12MMP9MMP2
SCHEMBL13571768 0.73 MMP1 (0.52) MMP1MMP12MMP9MMP2
SCHEMBL21322002 0.73 MMP1 (0.52) MMP1MMP12MMP9MMP2
SCHEMBL24112333 0.68 MMP1 (0.51) MMP1MMP12MMP9MMP2
SCHEMBL1161224 0.68 MMP1 (0.66) MMP1MMP12MMP9MMP2
SCHEMBL2897889 0.68 MMP1 (0.47) MMP1MMP12MMP9MMP2
SCHEMBL3724190 0.68 MMP1 (0.51) MMP1MMP12MMP9MMP2
SCHEMBL31453250 0.66 POLB (0.46) MMP1MMP12MMP9MMP2

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-2008109180-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 WO disclosed