SCHEMBL3214950

SCHEMBL3214950

O=C(/C=C/c1ccc(O)cc1)CC(=O)/C=C/c1cccc(Oc2ccccc2)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.70
PTGS2 P35354 2/20 0.59
AKR1B1 P15121 2/20 0.59
MAOB P27338 2/20 0.59
AKR1B10 O60218 1/20 0.59
GLO1 Q04760 1/20 0.59
CAMK2A Q9UQM7 1/20 0.59
ALOX5 P09917 2/20 0.56
PTGS1 P23219 1/20 0.56
MAPT P10636 2/20 0.55
APP P05067 1/20 0.55
GSK3B P49841 1/20 0.53
ABCB1 P08183 1/20 0.53
MAOA P21397 1/20 0.53
FFAR1 O14842 1/20 0.53
EPOR P19235 1/20 0.52

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
SCHEMBL3214959 1.00 BACE1 (0.70) BACE1PTGS2AKR1B1MAOBAKR1B10
SCHEMBL3213822 0.92 BACE1 (0.72) BACE1PTGS2ALOX5PTGS1MAPT
SCHEMBL3213833 0.92 BACE1 (0.72) BACE1PTGS2ALOX5PTGS1MAPT
SCHEMBL3221749 0.90 AKR1B10 (0.69) BACE1PTGS2AKR1B1MAOBAKR1B10
SCHEMBL3221759 0.90 AKR1B10 (0.69) BACE1PTGS2AKR1B1MAOBAKR1B10
SCHEMBL10349069 0.87 BACE1 (0.67) BACE1PTGS2ALOX5PTGS1MAPT
SCHEMBL10349067 0.87 BACE1 (0.67) BACE1PTGS2ALOX5PTGS1MAPT
SCHEMBL13253647 0.85 LTA4H (0.57) PTGS2ALOX5PTGS1MAPTAPP
SCHEMBL3209234 0.85 BACE1 (0.68) BACE1PTGS2AKR1B1MAOBAKR1B10
SCHEMBL3209220 0.85 BACE1 (0.68) BACE1PTGS2AKR1B1MAOBAKR1B10

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 1/4885PTGS2 1089/4885AKR1B1 1096/4885

“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.