SCHEMBL28891746

SCHEMBL28891746

O=C(/C=C\c1ccc(I)cc1)NCc1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 6/20 0.79
▸ MMP2 P08253 6/20 0.79
▸ MMP9 P14780 6/20 0.79
▸ HDAC3 O15379 2/20 0.60
▸ HDAC1 Q13547 2/20 0.60
▸ HDAC2 Q92769 2/20 0.60
▸ HDAC8 Q9BY41 1/20 0.60
▸ ALDH1A1 P00352 4/20 0.59
▸ LMNA P02545 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ POLB P06746 2/20 0.59
▸ RECQL P46063 1/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MAPT P10636 1/20 0.55
▸ NLRP3 Q96P20 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.55

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
N-Benzylcinnamamide SCHEMBL16644095 0.89 MMP1 (1.00) MMP1MMP2MMP9HDAC3HDAC1
N-Benzylcinnamamide SCHEMBL957076 0.89 MMP1 (1.00) MMP1MMP2MMP9HDAC3HDAC1
N-Benzylcinnamamide SCHEMBL28891771 0.89 MMP1 (1.00) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL8329811 0.86 MMP1 (1.00) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891910 0.85 MMP1 (0.79) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891864 0.85 MMP1 (0.79) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891810 0.85 MMP1 (0.79) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891814 0.85 MMP1 (0.79) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891815 0.82 MMP1 (0.75) MMP1MMP2MMP9HDAC3HDAC1
SCHEMBL28891946 0.81 MMP1 (0.73) MMP1MMP2MMP9HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115197037-B Preparation method of acrylamide and triazole-enamide alternating copolymer 大连理工大学 2023-11-28 — — CN disclosed
CN-115197037-A Preparation method of acrylamide and triazole-enamide alternating copolymer 大连理工大学 2022-10-18 — — CN disclosed
Send feedback