SCHEMBL3220744

SCHEMBL3220744

COc1cc(/C=C/C(=O)CC(=O)/C=C/c2cc(O)ccc2O)ccc1O

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 10/20 0.88
MAPT P10636 10/20 0.88
BACE1 P56817 10/20 0.84
ABCB1 P08183 2/20 0.81
AKR1B1 P15121 2/20 0.81
MAOA P21397 2/20 0.81
MAOB P27338 2/20 0.81
CYP2D6 P10635 2/20 0.80
CYP2C9 P11712 2/20 0.80
TSHR P16473 2/20 0.80
HSD17B10 Q99714 2/20 0.80
HDAC3 O15379 2/20 0.80
HDAC1 Q13547 2/20 0.80
HDAC2 Q92769 2/20 0.80
HDAC6 Q9UBN7 2/20 0.80
CYP2C19 P33261 1/20 0.80
KDM4E B2RXH2 1/20 0.80
MEN1 O00255 1/20 0.80
PTGES O14684 1/20 0.80
CA12 O43570 1/20 0.80

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
SCHEMBL3220764 1.00 APP (0.88) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3218221 0.94 APP (1.00) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3218205 0.94 APP (1.00) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3223918 0.91 BACE1 (0.86) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3223942 0.91 BACE1 (0.86) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3213952 0.91 BACE1 (1.00) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3213974 0.91 BACE1 (1.00) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3207903 0.91 BACE1 (1.00) APPMAPTBACE1ABCB1AKR1B1
SCHEMBL3207883 0.91 BACE1 (1.00) APPMAPTBACE1ABCB1AKR1B1
Curcumin SCHEMBL28278390 0.91 ABCB1 (0.97) APPMAPTBACE1ABCB1AKR1B1

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 APP 2/4885MAPT 8/4885BACE1 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.