SCHEMBL3215550

SCHEMBL3215550

COc1cc(/C=C/C(=O)CC(=O)/C=C/c2cc(Cl)cc(Cl)c2O)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 0.71
APP P05067 9/20 0.70
MAPT P10636 9/20 0.70
NFKB1 P19838 3/20 0.70
CYP2D6 P10635 2/20 0.70
CYP2C9 P11712 2/20 0.70
TSHR P16473 2/20 0.70
HSD17B10 Q99714 2/20 0.70
ABCB1 P08183 2/20 0.70
AKR1B1 P15121 2/20 0.70
MAOA P21397 2/20 0.70
MAOB P27338 2/20 0.70
HDAC3 O15379 2/20 0.70
HDAC1 Q13547 2/20 0.70
HDAC2 Q92769 2/20 0.70
HDAC6 Q9UBN7 2/20 0.70
ALOX5 P09917 2/20 0.70
MMP9 P14780 2/20 0.70
STAT3 P40763 2/20 0.70
NFKB2 Q00653 2/20 0.70

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
SCHEMBL3215566 1.00 BACE1 (0.71) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3207891 0.91 BACE1 (0.71) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3207904 0.91 BACE1 (0.71) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3218697 0.87 APP (0.72) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3208456 0.87 BACE1 (0.83) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3218683 0.87 APP (0.72) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3208442 0.87 BACE1 (0.83) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3215563 0.86 APP (0.82) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3215549 0.86 APP (0.82) BACE1APPMAPTNFKB1CYP2D6
SCHEMBL3220819 0.84 APP (0.84) BACE1APPMAPTNFKB1CYP2D6

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 BACE1 1/4885APP 2/4885MAPT 8/4885

“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.