SCHEMBL3207951

SCHEMBL3207951

O=C(C=Cc1ccc(O)cc1)CC(=O)C=Cc1ccc2oc(=O)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKR1B10 O60218 1/20 0.58
AKR1B1 P15121 1/20 0.58
MAOB P27338 1/20 0.58
PTGS2 P35354 1/20 0.58
GLO1 Q04760 1/20 0.58
CAMK2A Q9UQM7 1/20 0.58
CA12 O43570 10/20 0.55
CA9 Q16790 10/20 0.55
MCL1 Q07820 1/20 0.55
BACE1 P56817 7/20 0.54
SNCA P37840 2/20 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
SCHEMBL3207939 1.00 AKR1B10 (0.58) AKR1B10AKR1B1MAOBPTGS2GLO1
SCHEMBL29090524 0.84 F3 (0.56) MAOBCA12CA9MCL1SNCA
SCHEMBL30616109 0.84 F3 (0.56) MAOBCA12CA9MCL1SNCA
SCHEMBL29090521 0.84 F3 (0.56) MAOBCA12CA9MCL1SNCA
SCHEMBL30616108 0.84 F3 (0.56) MAOBCA12CA9MCL1SNCA
SCHEMBL11971153 0.79 CA9 (0.56) CA12CA9MCL1SNCA
SCHEMBL11971156 0.79 CA9 (0.56) CA12CA9MCL1SNCA
SCHEMBL3215584 0.77 BACE1 (0.70) AKR1B10AKR1B1MAOBPTGS2GLO1
SCHEMBL3215575 0.77 BACE1 (0.70) AKR1B10AKR1B1MAOBPTGS2GLO1
SCHEMBL11999784 0.77 ALDH1A1 (0.56) CA12CA9MCL1SNCA

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 AKR1B10 1428/4885AKR1B1 1096/4885MAOB 969/4885

“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.