SCHEMBL3209236

SCHEMBL3209236

COc1ccc(OC)c(/C=C/C(=O)CC(=O)/C=C/c2cc(OC)ccc2OC)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.77
NFKB1 P19838 1/20 0.77
BACE1 P56817 5/20 0.72
ABCG2 Q9UNQ0 1/20 0.70
PDE4A P27815 1/20 0.67
PDE4B Q07343 1/20 0.67
PDE4C Q08493 1/20 0.67
PDE4D Q08499 1/20 0.67
MAPT P10636 4/20 0.65
APP P05067 3/20 0.65
NFE2L2 Q16236 3/20 0.64
TDP1 Q9NUW8 1/20 0.62
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
ATM Q13315 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
GSK3B P49841 1/20 0.58
CYP1A1 P04798 1/20 0.58
CYP1A2 P05177 1/20 0.58

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
SCHEMBL3209264 1.00 JUN (0.77) JUNNFKB1BACE1ABCG2PDE4A
SCHEMBL3198142 0.89 BACE1 (0.81) JUNNFKB1BACE1MAPTAPP
SCHEMBL3198154 0.89 BACE1 (0.81) JUNNFKB1BACE1MAPTAPP
SCHEMBL3222902 0.88 MAPT (0.74) JUNNFKB1BACE1ABCG2MAPT
SCHEMBL3222924 0.88 MAPT (0.74) JUNNFKB1BACE1ABCG2MAPT
SCHEMBL8685581 0.87 JUN (0.77) JUNNFKB1BACE1ABCG2PDE4A
SCHEMBL3214610 0.87 BACE1 (0.80) BACE1MAPTAPPNFE2L2TDP1
SCHEMBL8685579 0.87 JUN (0.77) JUNNFKB1BACE1ABCG2PDE4A
SCHEMBL3214643 0.87 BACE1 (0.80) BACE1MAPTAPPNFE2L2TDP1
SCHEMBL3209158 0.87 APP (0.88) JUNNFKB1BACE1ABCG2MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962674-B2 Curcumin derivative TOKYO INSTITUTE OF TECHNOLOGY (JP) 2015-02-24 US disclosed
US-20100048901-A1 NOVEL CURCUMIN DERIVATIVE TOKYO INSTITUTE OF TECHNOLOGY (JP) 2010-02-25 US disclosed
EP-2123637-A1 NOVEL CURCUMIN DERIVATIVE Tokyo Institute of Technology (JP) 2009-11-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100048901-A1 NOVEL CURCUMIN DERIVATIVE BACE1, APP, BACE2 JUN 1901/4885NFKB1 213/4885BACE1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.