SCHEMBL6017258

SCHEMBL6017258

CC(=O)Oc1cc(/C=C/c2ccc(OC(C)=O)c(OC(C)=O)c2)cc(OC(C)=O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.71
TTR P02766 2/20 0.71
MAPT P10636 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
MEN1 O00255 1/20 0.71
LMNA P02545 1/20 0.71
TP53 P04637 1/20 0.71
CYP3A4 P08684 1/20 0.71
KMT2A Q03164 1/20 0.71
CYP19A1 P11511 1/20 0.65
JUN P05412 1/20 0.57
NFKB1 P19838 1/20 0.57
TUBB4A P04350 2/20 0.56
TUBB P07437 2/20 0.56
TUBA3C P0DPH7 2/20 0.56
TUBA1B P68363 2/20 0.56
TUBA4A P68366 2/20 0.56
TUBB4B P68371 2/20 0.56
TUBB3 Q13509 2/20 0.56
TUBB2A Q13885 2/20 0.56

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
SCHEMBL6017261 1.00 KDM4E (0.71) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL3483700 0.88 JUN (0.55) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL3483696 0.88 JUN (0.55) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL16192407 0.86 CYP1A1 (0.71) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL16192406 0.86 CYP1A1 (0.71) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL715253 0.84 LMNA (0.81) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL715254 0.84 LMNA (0.81) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL4263564 0.83 MAPT (0.69) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL4254083 0.83 MAPT (0.69) KDM4ETTRMAPTSMN1; SMN2MEN1
SCHEMBL715257 0.83 KDM4E (0.65) KDM4ETTRMAPTSMN1; SMN2MEN1

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
EP-1663926-A2 PROCESS FOR THE PREPARATION OF STILBENE DERIVATIVES DSM IP Assets B.V. (NL) 2006-06-07 EP disclosed
WO-2005023740-A2 PROCESS FOR THE PREPARATION OF STILBENE DERIVATIVES DSM IP ASSETS B.V. (NL) 2005-03-17 WO disclosed