SCHEMBL3214161

SCHEMBL3214161

O=C(C=Cc1ccc(O)cc1)CC(=O)C=Cc1cccc(-c2ccccc2)c1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 13/20 0.68
HDAC2 Q92769 1/20 0.68
HDAC8 Q9BY41 1/20 0.68
AKR1B1 P15121 2/20 0.65
MAOB P27338 2/20 0.65
AKR1B10 O60218 1/20 0.65
PTGS2 P35354 1/20 0.65
GLO1 Q04760 1/20 0.65
CAMK2A Q9UQM7 1/20 0.65
HAO1 Q9UJM8 1/20 0.59
APP P05067 1/20 0.56
MAPT P10636 1/20 0.56
RELA Q04206 1/20 0.54
ABCB1 P08183 1/20 0.53
MAOA P21397 1/20 0.53

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
SCHEMBL3214146 1.00 BACE1 (0.68) BACE1HDAC2HDAC8AKR1B1MAOB
SCHEMBL3211603 0.84 BACE1 (0.75) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL3211591 0.84 BACE1 (0.75) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL3222373 0.82 TTR (0.77) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL3222361 0.82 TTR (0.77) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL3214959 0.82 BACE1 (0.70) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL3214950 0.82 BACE1 (0.70) BACE1AKR1B1MAOBAKR1B10PTGS2
SCHEMBL2338070 0.81 HDAC2 (0.70) BACE1HDAC2HDAC8AKR1B1MAOB
SCHEMBL2338063 0.81 HDAC2 (0.70) BACE1HDAC2HDAC8AKR1B1MAOB
SCHEMBL3292933 0.81 HDAC2 (1.00) BACE1HDAC2HDAC8RELA

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 1/4885HDAC2 143/4885HDAC8 796/4885

“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.