SCHEMBL20538320

SCHEMBL20538320

COc1cc(/C=C/C(=O)Nc2cccc(/C=C/c3cc(OC)c(OC)c(OC)c3)c2)cc(OC)c1OC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.69
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
SMN1; SMN2 Q16637 4/20 0.67
ALDH1A1 P00352 3/20 0.67
HPGD P15428 3/20 0.67
KDM4E B2RXH2 2/20 0.67
LMNA P02545 2/20 0.67
GAA P10253 3/20 0.66
BCHE P06276 3/20 0.66
MAPT P10636 1/20 0.66
CA12 O43570 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
NPC1 O15118 1/20 0.63
STAT1 P42224 1/20 0.63
RAB9A P51151 1/20 0.63
POLB P06746 1/20 0.63
KDM1A O60341 2/20 0.61

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
SCHEMBL20538322 1.00 HTT (0.69) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537938 0.96 MEN1 (0.66) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537942 0.96 MEN1 (0.66) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537939 0.96 MEN1 (0.66) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20538610 0.95 MMP1 (0.69) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20538609 0.95 MMP1 (0.69) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537987 0.95 MEN1 (0.72) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL19801028 0.95 MEN1 (0.72) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537944 0.94 BCHE (0.69) HTTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20537940 0.94 BCHE (0.69) HTTMEN1KMT2ASMN1; SMN2ALDH1A1

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