SCHEMBL20538516

SCHEMBL20538516

COc1cc(/C=C/c2cccc(O)c2NC(=O)/C=C/c2ccc(O)c(O)c2)cc(OC)c1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.57
MMP2 P08253 4/20 0.57
MMP9 P14780 4/20 0.57
BCHE P06276 2/20 0.57
KDM1A O60341 3/20 0.54
MAPT P10636 2/20 0.54
APP P05067 1/20 0.54
BACE1 P56817 2/20 0.54
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
THRB P10828 1/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TUBB1 Q9H4B7 2/20 0.52
HDAC3 O15379 1/20 0.52
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52
HDAC4 P56524 1/20 0.52
TUBA1B P68363 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
SCHEMBL20538518 1.00 MMP1 (0.57) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538433 0.95 KDM1A (0.61) MMP9BCHEKDM1AMAPTAPP
SCHEMBL20538435 0.95 KDM1A (0.61) MMP9BCHEKDM1AMAPTAPP
SCHEMBL20537779 0.94 MMP1 (0.60) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20537780 0.94 MMP1 (0.60) MMP1MMP2MMP9BCHEKDM1A
SCHEMBL20538072 0.94 BCHE (0.66) BCHEKDM1AMAPTAPPBACE1
SCHEMBL20538070 0.94 BCHE (0.66) BCHEKDM1AMAPTAPPBACE1
SCHEMBL20537712 0.94 HTT (0.57) BCHEKDM1AMAPTAPPBACE1
SCHEMBL20537714 0.94 HTT (0.57) BCHEKDM1AMAPTAPPBACE1
SCHEMBL20537896 0.93 BCHE (0.58) BCHEKDM1AMAPTAPPBACE1

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