SCHEMBL29913624

SCHEMBL29913624

O=C(C=Cc1ccc(O)cc1)Nc1c(O)cccc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.59
MMP2 P08253 11/20 0.59
MMP9 P14780 11/20 0.59
LTB4R Q15722 2/20 0.56
TRPM2 O94759 1/20 0.56
DEGS1 O15121 1/20 0.55
TRPA1 O75762 5/20 0.54
TRPM8 Q7Z2W7 2/20 0.54
MAOA P21397 3/20 0.52
MAOB P27338 3/20 0.52
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52

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
SCHEMBL19858953 1.00 MMP1 (0.59) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL14801853 1.00 MMP1 (0.59) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL14801687 0.92 MMP1 (0.61) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL14801681 0.92 MMP1 (0.61) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL14801990 0.88 MMP1 (0.65) MMP1MMP2MMP9MAOAMAOB
SCHEMBL23781993 0.86 MMP1 (0.63) MMP1MMP2MMP9MAOAMAOB
SCHEMBL14801863 0.86 MMP1 (0.63) MMP1MMP2MMP9MAOAMAOB
SCHEMBL14801934 0.82 NFKB1 (0.53) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL8213614 0.82 NFKB1 (0.53) MMP1MMP2MMP9LTB4RTRPM2
SCHEMBL29401064 0.81 TRPM2 (0.81) MMP1MMP2MMP9LTB4RTRPM2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4114349-A1 COMPOSITION OR OAT EXTRACT COMPRISING AVENANTHRAMIDE AND BETA-GLUCAN Symrise AG (DE) 2023-01-11 EP disclosed
EP-4114348-A1 COMPOSITION COMPRISING AN AVENTHRAMIDE OR AN ANALOGUE THEREOF WITH IMPROVED STABILITY Symrise AG (DE) 2023-01-11 EP disclosed
EP-4114354-A1 AVENANTHRAMIDE COMPOSITIONS WITH IMPROVED SOLUBILITY COMPRISING 4-HYDROXYPHENONE Symrise AG (DE) 2023-01-11 EP disclosed
CN-115279333-A Composition or oat extract comprising avenanthramide and beta-glucan 西姆莱斯股份公司 2022-11-01 CN disclosed
CN-115243669-A Avenanthramide compositions with enhanced solubility comprising 4-hydroxybenzophenones 西姆莱斯股份公司 2022-10-25 CN disclosed
CN-115243670-A Cosmetic or pharmaceutical use of avenanthramide L 西姆莱斯股份公司 2022-10-25 CN disclosed
CN-115243664-A Compositions comprising avenanthramides for increasing skin permeability 西姆莱斯股份公司 2022-10-25 CN disclosed
CN-115209864-A Compositions comprising avenanthramides or analogs thereof having improved stability 西姆莱斯股份公司 2022-10-18 CN disclosed