SCHEMBL1648423

SCHEMBL1648423

CN(C)c1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)c([N+](=O)[O-])c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 1.00
PTGS2 P35354 2/20 0.67
AKR1B10 O60218 1/20 0.51
AKR1B1 P15121 1/20 0.51
MAOB P27338 1/20 0.51
GLO1 Q04760 1/20 0.51
CAMK2A Q9UQM7 1/20 0.51

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
SCHEMBL1648421 1.00 BACE1 (1.00) BACE1PTGS2AKR1B10AKR1B1MAOB
SCHEMBL1650914 0.90 PTGS2 (0.82) BACE1PTGS2
SCHEMBL1650911 0.90 PTGS2 (0.82) BACE1PTGS2
SCHEMBL1646124 0.85 BACE1 (1.00) BACE1PTGS2
SCHEMBL1646127 0.85 BACE1 (1.00) BACE1PTGS2
SCHEMBL1645461 0.84 BACE1 (0.73) BACE1PTGS2
SCHEMBL1645458 0.84 BACE1 (0.73) BACE1PTGS2
SCHEMBL3211817 0.84 BACE1 (1.00) BACE1PTGS2AKR1B1MAOBGLO1
SCHEMBL3211811 0.84 BACE1 (1.00) BACE1PTGS2AKR1B1MAOBGLO1
SCHEMBL3211232 0.84 BACE1 (1.00) BACE1PTGS2

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 5 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-8552220-B2 Therapeutic agent for Alzheimer's disease TOKYO INSTITUTE OF TECHNOLOGY (JP) 2013-10-08 US disclosed
EP-2305629-A1 THERAPEUTIC AGENT FOR ALZHEIMER'S DISEASE Tokyo Institute of Technology (JP) 2011-04-06 EP 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 1/4885PTGS2 1089/4885AKR1B10 1428/4885

“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.