SCHEMBL20537765

SCHEMBL20537765

COc1cc(/C=C/c2cccc(NC(=O)/C=C/c3ccc(O)c(O)c3)c2)cc(OC)c1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 8/20 0.69
MMP2 P08253 8/20 0.69
MMP9 P14780 8/20 0.69
BCHE P06276 2/20 0.67
KDM1A O60341 4/20 0.65
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
HTT P42858 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
HPGD P15428 1/20 0.58
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
NPC1 O15118 1/20 0.58
STAT1 P42224 1/20 0.58
RAB9A P51151 1/20 0.58

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
SCHEMBL20537768 1.00 MMP1 (0.69) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538415 0.94 KDM1A (0.73) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538413 0.94 KDM1A (0.73) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538161 0.94 BCHE (0.77) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538158 0.94 BCHE (0.77) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538320 0.92 HTT (0.69) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538322 0.92 HTT (0.69) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL17513860 0.90 MMP1 (0.66) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20537987 0.90 MEN1 (0.72) BCHEKDM1AMEN1KMT2AHTT
SCHEMBL20538609 0.90 MMP1 (0.69) MMP1MMP2MMP9BCHEMEN1

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-3183230-B1 N-((3,4,5-TRIMETHOXYSTYRYL)ARYL)CINNAMAMIDE COMPOUNDS AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2018-10-24 EP claimed