SCHEMBL20537942

SCHEMBL20537942

COc1cc(C=Cc2cccc(NC(=O)C=Cc3ccccc3)c2)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
MMP1 P03956 2/20 0.66
MMP2 P08253 2/20 0.66
MMP9 P14780 2/20 0.66
NPC1 O15118 1/20 0.66
STAT1 P42224 1/20 0.66
RAB9A P51151 1/20 0.66
HTT P42858 2/20 0.65
ALDH1A1 P00352 3/20 0.63
HPGD P15428 3/20 0.63
KDM4E B2RXH2 2/20 0.63
LMNA P02545 2/20 0.63
KDM1A O60341 1/20 0.63
BCHE P06276 2/20 0.62
GAA P10253 3/20 0.62
MAPT P10636 1/20 0.62
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60

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
SCHEMBL20537938 1.00 MEN1 (0.66) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20537939 1.00 MEN1 (0.66) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20538320 0.96 HTT (0.69) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20538322 0.96 HTT (0.69) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL17513860 0.92 MMP1 (0.66) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL19801055 0.92 SMN1; SMN2 (0.65) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20538062 0.92 MMP1 (0.66) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL19801059 0.92 SMN1; SMN2 (0.65) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20538609 0.92 MMP1 (0.69) MEN1KMT2ASMN1; SMN2MMP1MMP2
SCHEMBL20537987 0.92 MEN1 (0.72) MEN1KMT2ASMN1; SMN2NPC1STAT1

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