SCHEMBL4174537

SCHEMBL4174537

C=CC(OC(C)=O)c1ccc(OC(C)=O)cc1OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
MAPT P10636 4/20 0.43
MAPK1 P28482 1/20 0.43
ACHE P22303 2/20 0.40
LMNA P02545 5/20 0.39
PKM P14618 2/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
TTR P02766 1/20 0.38
TP53 P04637 1/20 0.38
BACE1 P56817 1/20 0.37
PTGS1 P23219 1/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36

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
SCHEMBL8699864 0.86 KDM4E (0.48) KDM4EMAPTMAPK1ACHELMNA
1'-Acetoxychavicol Acetate SCHEMBL17454871 0.77 LMNA (0.47) KDM4EMAPTACHELMNAPKM
1'-Acetoxychavicol Acetate SCHEMBL3673490 0.77 LMNA (0.47) KDM4EMAPTACHELMNAPKM
SCHEMBL4174338 0.74 TSHR (0.45) KDM4ELMNARAB9ACYP3A4PTGS1
SCHEMBL11781019 0.73 KDM4E (0.38) KDM4EMAPTMAPK1ACHELMNA
SCHEMBL10351088 0.72 KDM4E (0.51) KDM4EMAPTMAPK1ACHELMNA
SCHEMBL30785274 0.72 KDM4E (0.56) KDM4EMAPTMAPK1ACHELMNA
SCHEMBL3627110 0.72 KDM4E (0.56) KDM4EMAPTMAPK1ACHELMNA
SCHEMBL25784438 0.72 KDM4E (0.51) KDM4EMAPTMAPK1ACHELMNA
SCHEMBL29440769 0.70 KDM4E (0.67) KDM4EMAPTMAPK1ACHELMNA

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
JP-2009079004-A COLLAGEN PRODUCTION PROMOTER OSAKA INDUSTRIAL PROMOTION ORGANIZATION 2009-04-16 JP disclosed