SCHEMBL3206113

SCHEMBL3206113

CCN(CC)c1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)c(OCc2cccnc2)c1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 17/20 0.80
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
THRB P10828 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL3206103 1.00 BACE1 (0.80) BACE1MAPK1NPSR1THRBALDH1A1
SCHEMBL3211707 0.89 BACE1 (1.00) BACE1
SCHEMBL3211720 0.89 BACE1 (1.00) BACE1
SCHEMBL3218223 0.83 BACE1 (0.82) BACE1
SCHEMBL3218231 0.83 BACE1 (0.82) BACE1
SCHEMBL3200425 0.82 BACE1 (0.79) BACE1
SCHEMBL3200409 0.82 BACE1 (0.79) BACE1
SCHEMBL3218717 0.81 BACE1 (0.86) BACE1ALDH1A1LMNA
SCHEMBL3218705 0.81 BACE1 (0.86) BACE1ALDH1A1LMNA
SCHEMBL3214682 0.81 BACE1 (1.00) BACE1

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 1/4885MAPK1 921/4885NPSR1 1048/4885

“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.