SCHEMBL6013373

SCHEMBL6013373

O=C(C=Cc1cccc(O)c1)Nc1cccc(C(=O)O)c1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 14/20 0.79
MMP2 P08253 14/20 0.79
MMP9 P14780 14/20 0.79
MAOB P27338 2/20 0.70
LTB4R Q15722 1/20 0.68
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
P4HB P07237 1/20 0.60
HDAC3 O15379 1/20 0.59
HDAC4 P56524 1/20 0.59
HDAC1 Q13547 1/20 0.59
HDAC7 Q8WUI4 1/20 0.59
HDAC2 Q92769 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
HDAC9 Q9UKV0 1/20 0.59
HDAC5 Q9UQL6 1/20 0.59

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
SCHEMBL6013371 1.00 MMP1 (0.79) MMP1MMP2MMP9MAOBLTB4R
SCHEMBL8049032 0.89 LTB4R (0.84) MMP1MMP2MMP9MAOBLTB4R
SCHEMBL8049033 0.89 LTB4R (0.84) MMP1MMP2MMP9MAOBLTB4R
SCHEMBL28316655 0.89 MMP1 (1.00) MMP1MMP2MMP9MAOB
SCHEMBL6013359 0.88 MMP1 (0.79) MMP1MMP2MMP9MAOBMEN1
SCHEMBL6013360 0.88 MMP1 (0.79) MMP1MMP2MMP9MAOBMEN1
3-Hydroxy-Cinnamanilide SCHEMBL28903001 0.87 MMP1 (1.00) MMP1MMP2MMP9MAOB
3-Hydroxy-Cinnamanilide SCHEMBL30031823 0.87 MMP1 (1.00) MMP1MMP2MMP9MAOB
SCHEMBL8065865 0.85 MAOB (0.73) MMP1MMP2MMP9MAOBLTB4R
SCHEMBL8065866 0.85 MAOB (0.73) MMP1MMP2MMP9MAOBLTB4R

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-2006117602-A2 USE OF AMIDE DERIVATIVES AS TASTE-MODIFYING AGENTS, FLAVOURING COMPOSITIONS AND PRODUCTS CONTAINING THEM UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2006-11-09 WO claimed